data_2gyt_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 2gyt _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 C--O 1.217 -0.62 0 CA-C-O 117.475 -1.25 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.449 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.489 -1.243 . . . . 0.0 112.011 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.453 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.453 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 C--O 1.218 -0.575 0 CA-C-O 117.384 -1.293 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.464 0.274 0 CA-C-O 119.055 -0.498 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.581 0 CA-C-O 117.685 -1.15 . . . . 0.0 110.687 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 120.603 0.239 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CZ ' HD21 ' A' ' 39' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.403 HD21 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CZ ' HD21 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.411 HD21 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.218 -0.554 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.454 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.698 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.436 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.436 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptt? . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.1 p -69.94 123.17 20.83 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.189 -1.57 . . . . 0.0 111.222 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -166.81 -56.12 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.586 1.154 . . . . 0.0 112.266 173.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -76.42 165.2 25.16 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.279 1.431 . . . . 0.0 111.837 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.4 tttt -57.1 135.98 80.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 124.636 1.174 . . . . 0.0 110.559 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.85 46.06 1.43 Allowed 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.748 3.632 . . . . 0.0 113.486 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.9 -46.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.158 1.783 . . . . 0.0 111.411 175.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -60.0 -36.41 77.13 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 6.0 mmt -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.92 1.288 . . . . 0.0 112.717 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.5 mt -88.88 -35.25 7.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.239 -1.362 . . . . 0.0 110.588 176.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.56 -41.81 61.4 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.783 1.629 . . . . 0.0 111.556 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.06 -32.64 73.19 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 171.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -81.61 -41.57 21.29 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.817 -1.177 . . . . 0.0 113.514 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.265 3.1 tt -60.8 -33.39 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.421 . . . . 0.0 110.008 167.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -57.88 -19.88 32.71 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 121.632 2.015 . . . . 0.0 114.712 171.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.4 -45.89 9.61 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.628 1.103 . . . . 0.0 112.885 165.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -43.48 84.24 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.107 -0.996 . . . . 0.0 112.587 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.36 -31.85 72.88 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m -63.68 -14.18 49.78 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.91 -55.61 4.49 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.991 1.269 . . . . 0.0 110.359 169.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.6 m -67.84 -33.56 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 O-C-N 121.521 -0.737 . . . . 0.0 112.368 -177.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm -56.03 -44.53 78.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.903 1.281 . . . . 0.0 111.609 170.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.11 87.67 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.644 0.778 . . . . 0.0 112.222 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.09 -32.57 65.07 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -105.44 27.48 8.3 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.828 1.651 . . . . 0.0 112.909 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.63 -16.39 10.38 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.047 1.739 . . . . 0.0 113.637 172.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -52.97 -41.79 64.9 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.988 1.315 . . . . 0.0 113.174 164.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.4 mt -77.32 162.0 27.64 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.406 1.082 . . . . 0.0 111.413 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.74 160.04 31.11 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.372 -0.83 . . . . 0.0 112.191 173.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -53.77 -33.73 56.76 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.808 0.843 . . . . 0.0 113.218 166.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -65.97 -46.81 76.74 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.931 0.892 . . . . 0.0 112.123 174.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.4 96.99 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.12 0.568 . . . . 0.0 111.264 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -36.99 77.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 CA-C-O 117.288 -1.339 . . . . 0.0 112.699 174.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.12 -37.75 81.47 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 121.586 1.994 . . . . 0.0 111.846 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.39 -22.62 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 20.1 mtm -109.14 27.41 9.55 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -174.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 128.499 2.72 . . . . 0.0 116.303 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 m 52.4 177.19 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.299 1.44 . . . . 0.0 114.712 -161.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -85.36 156.44 20.88 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.429 1.492 . . . . 0.0 111.7 172.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 pttt -87.79 94.25 9.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.987 1.715 . . . . 0.0 111.236 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -59.01 126.82 82.5 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-O 117.896 -1.049 . . . . 0.0 111.217 177.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.49 44.56 1.41 Allowed 'Trans proline' 0 CA--C 1.55 1.279 1 C-N-CA 125.42 4.08 . . . . 0.0 114.008 -172.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.64 -61.17 0.15 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.319 1.448 . . . . 0.0 110.489 171.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -62.0 -36.83 82.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.142 0.977 . . . . 0.0 113.389 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 11.0 mmt -64.07 -24.54 67.74 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.105 0.962 . . . . 0.0 112.932 175.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.8 mt -93.08 -36.91 7.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 C-N-CA 124.994 1.317 . . . . 0.0 110.12 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -50.93 -43.05 60.05 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.425 1.49 . . . . 0.0 112.18 174.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 m -61.14 -34.21 74.64 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -46.02 44.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.389 1.076 . . . . 0.0 112.385 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.275 1.0 OUTLIER -62.48 -36.11 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.396 175.487 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.11 -21.77 14.21 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 121.24 1.837 . . . . 0.0 115.282 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.7 -43.34 18.62 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 119.856 1.207 . . . . 0.0 113.236 167.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -39.03 61.42 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.758 -1.214 . . . . 0.0 112.836 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -63.92 -30.66 71.72 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.749 1.619 . . . . 0.0 110.837 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.449 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -49.21 76.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -45.3 93.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.286 0.635 . . . . 0.0 110.744 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -39.64 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.52 -40.87 96.42 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.649 1.58 . . . . 0.0 111.501 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 -66.48 -28.15 68.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.401 1.08 . . . . 0.0 112.867 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -83.17 -41.87 17.96 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 7.3 m170 -103.48 48.71 0.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.308 1.843 . . . . 0.0 110.855 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -81.42 -2.19 48.55 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.042 -1.036 . . . . 0.0 113.415 173.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -62.55 -17.87 60.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.569 1.548 . . . . 0.0 113.953 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pp -111.43 165.68 11.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.262 2.225 . . . . 0.0 111.529 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -63.53 148.47 48.66 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.022 0.529 . . . . 0.0 111.41 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 -53.25 -32.32 47.84 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.235 -0.916 . . . . 0.0 112.395 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -61.39 -39.97 92.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.817 0.847 . . . . 0.0 112.736 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.25 -35.28 73.69 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.284 170.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.84 -37.23 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 120.03 1.287 . . . . 0.0 112.012 171.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -68.15 -42.35 80.24 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 121.008 1.731 . . . . 0.0 111.881 176.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.449 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -81.07 -14.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 17.3 ptm -136.25 47.38 2.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.827 1.651 . . . . 0.0 112.805 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.0 pttp . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.532 1.933 . . . . 0.0 115.174 -179.707 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.327 0.108 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 50.7 t -137.73 -53.82 0.66 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.904 1.282 . . . . 0.0 111.419 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -68.68 166.6 16.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.474 1.51 . . . . 0.0 111.648 165.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt 56.74 171.55 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 126.724 2.01 . . . . 0.0 114.181 -169.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -61.15 147.51 86.46 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 123.874 0.87 . . . . 0.0 110.923 175.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -68.45 128.08 16.69 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 122.402 2.068 . . . . 0.0 111.539 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 56.16 35.97 26.61 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 127.355 2.262 . . . . 0.0 116.301 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.9 t -53.24 -37.73 62.35 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -33.05 72.99 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 120.991 -1.068 . . . . 0.0 112.332 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.2 mt -84.59 -35.32 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 117.413 -1.279 . . . . 0.0 110.093 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.74 -42.42 46.2 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 121.209 1.822 . . . . 0.0 112.734 174.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 m -58.38 -39.56 79.95 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.962 -1.086 . . . . 0.0 113.831 171.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -75.73 -38.31 58.61 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.504 1.047 . . . . 0.0 112.791 173.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.254 0.5 OUTLIER -61.96 -44.96 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 120.155 1.343 . . . . 0.0 109.266 174.821 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.16 -28.25 66.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.807 1.185 . . . . 0.0 113.372 177.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.06 -48.31 63.1 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 120.152 1.342 . . . . 0.0 113.809 170.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -84.79 -29.79 25.13 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 121.147 -0.971 . . . . 0.0 113.612 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -24.94 63.24 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.324 1.849 . . . . 0.0 112.011 165.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.453 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.33 -19.24 63.12 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.98 -45.33 13.24 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.229 1.011 . . . . 0.0 110.202 166.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -62.44 -41.9 93.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -19.88 65.91 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.885 1.274 . . . . 0.0 114.262 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -84.34 -42.11 16.09 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.261 1.025 . . . . 0.0 112.459 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.24 -28.34 63.09 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.11 0.868 . . . . 0.0 113.055 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -114.68 36.59 3.75 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.386 2.274 . . . . 0.0 111.185 176.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -57.39 -14.79 5.2 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -54.21 -39.06 66.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.719 2.008 . . . . 0.0 112.761 167.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 47.2 mt -78.66 143.59 36.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.845 1.258 . . . . 0.0 110.46 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.49 160.27 14.01 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 121.347 -0.845 . . . . 0.0 112.624 171.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -57.67 -33.12 68.01 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.566 -0.709 . . . . 0.0 112.572 173.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -66.72 -43.82 83.23 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.685 0.794 . . . . 0.0 111.871 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.87 96.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.536 0.734 . . . . 0.0 111.063 170.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -35.67 72.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 117.384 -1.293 . . . . 0.0 112.738 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -66.83 -44.57 80.77 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.347 1.885 . . . . 0.0 112.091 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.453 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.23 -26.84 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.0 mmt -90.65 23.77 2.93 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 128.147 2.579 . . . . 0.0 112.828 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.9 mttt . . . . . 0 C--O 1.255 1.346 0 C-N-CA 126.998 2.119 . . . . 0.0 111.583 -179.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ptp . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 119.732 -0.175 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.5 t 47.0 74.13 0.16 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.774 2.03 . . . . 0.0 114.329 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -46.76 0.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -173.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.82 26.01 3.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.847 1.659 . . . . 0.0 113.21 -176.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -55.02 150.31 20.32 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.141 1.376 . . . . 0.0 112.809 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.35 -17.92 30.35 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 113.374 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -145.77 107.58 4.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.511 1.924 . . . . 0.0 108.489 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.6 t -122.03 -32.91 3.63 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.755 1.222 . . . . 0.0 112.697 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.2 mmt -58.36 -31.4 67.58 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.316 1.046 . . . . 0.0 112.656 170.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.1 mt -94.42 -27.95 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.226 175.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.9 tp -53.69 -40.07 65.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 121.107 1.776 . . . . 0.0 112.476 175.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 m -59.5 -38.14 80.12 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.97 0.908 . . . . 0.0 112.887 172.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -76.48 -38.39 55.4 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.318 -0.864 . . . . 0.0 112.882 174.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -65.06 -37.41 80.15 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 CA-C-N 119.828 1.195 . . . . 0.0 109.79 172.463 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -60.33 -28.34 68.07 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 120.357 1.435 . . . . 0.0 113.477 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.5 -53.46 23.09 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.328 0.967 . . . . 0.0 112.135 169.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 pttt -73.69 -32.16 63.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -71.52 -36.45 71.04 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 126.161 1.784 . . . . 0.0 110.242 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t -54.23 -40.06 67.33 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.93 -40.3 60.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.416 1.486 . . . . 0.0 112.395 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.3 -36.12 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.506 -0.746 . . . . 0.0 112.156 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -60.94 -37.26 81.72 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.739 2.016 . . . . 0.0 112.336 173.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -65.02 -31.77 73.17 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.088 0.955 . . . . 0.0 113.209 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -81.02 -16.03 54.49 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -85.59 -5.17 59.3 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.88 1.272 . . . . 0.0 113.677 177.287 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -47.0 -22.76 0.37 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -170.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.24 2.216 . . . . 0.0 114.393 168.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.59 -170.14 2.51 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 128.933 2.893 . . . . 0.0 110.031 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -107.11 151.36 25.48 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.44 -1.413 . . . . 0.0 111.782 173.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.16 -29.23 1.47 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.99 -33.96 70.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.518 1.127 . . . . 0.0 112.644 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.18 -36.68 77.58 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.394 1.077 . . . . 0.0 111.539 167.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -43.43 97.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 CA-C-N 120.356 1.434 . . . . 0.0 111.553 168.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -60.6 -28.04 68.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 121.787 2.085 . . . . 0.0 112.441 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m -96.21 -24.38 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 6.5 ptm -118.84 15.74 13.47 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -173.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.2 mttt . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 128.395 2.678 . . . . 0.0 114.913 -173.383 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.3 p -140.5 41.48 1.89 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.566 1.546 . . . . 0.0 111.397 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -48.81 157.32 0.4 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.882 1.273 . . . . 0.0 112.164 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.18 118.4 2.12 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.311 0.644 . . . . 0.0 110.325 176.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -75.61 138.37 70.51 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 118.158 -0.925 . . . . 0.0 108.631 -175.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -68.17 -177.65 1.45 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.435 2.09 . . . . 0.0 111.416 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -68.3 33.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 126.156 1.783 . . . . 0.0 114.856 -176.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.3 t -73.48 -35.47 65.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.942 2.097 . . . . 0.0 113.731 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.8 mmt -58.46 -34.25 70.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.168 0.987 . . . . 0.0 111.892 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.0 mt -85.78 -41.92 15.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 CA-C-O 117.334 -1.317 . . . . 0.0 110.671 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.44 -39.36 57.23 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 120.99 1.723 . . . . 0.0 112.146 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -62.2 -39.48 92.9 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.179 0.992 . . . . 0.0 113.651 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -74.69 -34.23 62.59 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.119 -0.988 . . . . 0.0 113.169 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -36.94 78.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.682 0 CA-C-N 120.442 1.474 . . . . 0.0 109.591 172.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -59.25 -13.89 9.27 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.708 1.14 . . . . 0.0 113.902 173.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.07 -46.82 14.41 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.074 1.306 . . . . 0.0 113.206 165.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -83.35 -39.68 20.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -71.73 -19.54 62.03 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.267 1.827 . . . . 0.0 111.836 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m -58.21 -28.57 64.95 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 tt -71.04 -60.16 2.38 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.767 1.167 . . . . 0.0 110.653 174.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 11.2 m -63.43 -32.63 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -61.85 -48.51 80.22 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.951 1.3 . . . . 0.0 111.437 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -62.6 -39.3 93.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.135 0.974 . . . . 0.0 112.216 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.28 -36.42 74.38 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -75.51 0.13 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.11 0.868 . . . . 0.0 110.887 171.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.8 t70 39.62 36.25 0.23 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.405 1.882 . . . . 0.0 113.835 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -134.04 -47.66 0.79 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.587 1.555 . . . . 0.0 111.862 -165.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.5 mt -69.58 170.81 9.96 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.74 1.216 . . . . 0.0 110.654 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -63.36 157.73 22.29 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.194 -0.941 . . . . 0.0 112.794 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.61 -36.94 62.52 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 121.282 -0.887 . . . . 0.0 112.688 167.176 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -34.79 76.07 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.401 1.081 . . . . 0.0 112.123 176.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.71 84.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.948 173.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.71 -40.93 90.87 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.689 172.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.54 -39.31 88.52 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.276 1.853 . . . . 0.0 112.804 176.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m -92.81 -32.5 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 mtp -88.48 50.18 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.077 2.151 . . . . 0.0 111.149 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.0 tttp . . . . . 0 C--O 1.256 1.405 0 C-N-CA 128.003 2.521 . . . . 0.0 114.603 171.27 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -57.06 166.28 1.09 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.675 0.79 . . . . 0.0 112.549 166.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 58.49 -70.33 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 127.407 2.283 . . . . 0.0 113.926 -171.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.57 63.86 4.12 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.077 2.151 . . . . 0.0 110.521 175.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -59.89 146.43 81.86 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 111.556 172.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.73 -14.55 30.06 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.273 2.649 . . . . 0.0 112.412 176.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -125.57 125.86 43.86 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.281 1.432 . . . . 0.0 110.184 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -131.37 -42.39 1.06 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.506 . . . . 0.0 111.103 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -49.39 74.68 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.04 1.336 . . . . 0.0 111.541 171.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -80.06 -32.95 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 116.992 -1.48 . . . . 0.0 110.896 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -51.94 -41.31 61.95 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.141 1.792 . . . . 0.0 111.658 174.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -60.6 -38.51 84.88 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 170.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -73.08 -42.68 62.75 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.804 -1.185 . . . . 0.0 113.696 174.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.296 0.8 OUTLIER -59.66 -43.05 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-O 116.793 -1.575 . . . . 0.0 109.273 170.289 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.76 -17.56 9.49 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 121.74 2.064 . . . . 0.0 114.858 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -90.54 -43.85 9.95 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.481 1.037 . . . . 0.0 112.977 168.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -43.35 89.65 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 119.501 1.046 . . . . 0.0 111.854 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -30.93 64.3 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 125.094 1.358 . . . . 0.0 110.687 177.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t -59.67 -31.91 69.98 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tt -81.94 -38.3 25.44 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.083 1.353 . . . . 0.0 112.056 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -37.52 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 O-C-N 120.865 -1.147 . . . . 0.0 112.72 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -48.27 82.53 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.909 1.283 . . . . 0.0 111.715 176.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -64.92 -34.68 78.98 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -72.86 -35.3 67.17 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m80 -119.86 62.47 0.83 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.485 1.914 . . . . 0.0 110.067 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -92.02 10.55 28.59 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.858 1.663 . . . . 0.0 112.02 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -64.03 -18.71 64.6 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.849 1.66 . . . . 0.0 113.721 176.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.7 165.47 17.88 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.67 2.388 . . . . 0.0 111.058 -177.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 -63.02 160.85 14.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.629 0.772 . . . . 0.0 112.226 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 52.8 mtm-85 -56.26 -31.88 63.99 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.145 -0.972 . . . . 0.0 112.721 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.28 -39.05 93.49 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.96 0.904 . . . . 0.0 112.33 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.55 -38.59 84.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.422 -0.799 . . . . 0.0 111.188 172.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -39.09 84.33 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.371 170.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.12 -36.52 83.38 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.177 1.808 . . . . 0.0 111.361 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m -88.35 -35.07 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.2 ptm -86.06 19.14 2.73 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.799 1.64 . . . . 0.0 112.3 179.221 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tpp . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.666 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t 59.48 179.44 0.08 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 125.485 1.514 . . . . 0.0 112.828 -168.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 42.77 94.92 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.744 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mttt 67.06 108.13 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.575 2.35 . . . . 0.0 111.55 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -59.52 149.04 72.15 Favored Pre-proline 0 N--CA 1.472 0.652 0 C-N-CA 124.019 0.928 . . . . 0.0 111.614 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -74.99 71.04 5.13 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.962 3.108 . . . . 0.0 111.892 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 59.51 103.79 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.697 2.799 . . . . 0.0 113.565 -176.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.2 t -52.77 -34.84 54.95 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.499 -1.376 . . . . 0.0 114.106 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtp -62.74 -28.19 69.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.41 1.484 . . . . 0.0 113.116 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -94.54 -33.04 4.81 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.373 173.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.38 -41.47 60.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 121.176 1.807 . . . . 0.0 111.763 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.76 -37.0 80.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 171.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -75.29 -41.39 57.19 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.079 -1.013 . . . . 0.0 113.458 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.1 tt -62.25 -41.66 92.32 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 CA-C-N 120.323 1.419 . . . . 0.0 109.557 170.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.91 -22.09 13.75 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.118 1.781 . . . . 0.0 114.557 173.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.13 -46.97 26.14 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.756 1.162 . . . . 0.0 113.257 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -77.54 -38.28 49.0 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.68 -19.47 62.07 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 126.084 1.754 . . . . 0.0 111.392 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' CZ ' HD21 ' A' ' 39' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.403 HD21 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.55 -28.15 66.86 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.62 -45.48 13.43 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.057 0.943 . . . . 0.0 111.386 171.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -65.5 -33.73 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -62.89 -29.94 71.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.685 1.594 . . . . 0.0 111.686 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -66.82 -33.31 75.33 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.971 -1.081 . . . . 0.0 111.98 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -76.69 12.86 1.15 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.995 1.718 . . . . 0.0 114.03 165.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.37 6.37 11.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.907 1.683 . . . . 0.0 112.607 172.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -28.31 1.77 Allowed 'General case' 0 CA--C 1.553 1.095 0 O-C-N 120.405 -1.434 . . . . 0.0 114.724 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -94.19 -17.94 22.22 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.412 1.885 . . . . 0.0 115.096 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 77.1 mt -82.54 -179.02 7.29 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.537 1.935 . . . . 0.0 111.985 172.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -97.24 156.49 16.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.438 1.495 . . . . 0.0 112.487 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -53.8 -41.37 67.22 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.26 -0.9 . . . . 0.0 112.241 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.56 -37.11 86.05 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.637 0.775 . . . . 0.0 112.956 172.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.96 95.54 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.957 0.799 . . . . 0.0 111.431 173.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.78 -45.68 83.92 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-O 116.799 -1.572 . . . . 0.0 112.095 169.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.21 -33.48 73.55 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 122.228 2.286 . . . . 0.0 112.278 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.18 -36.07 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.7 ptm -85.03 3.65 37.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.238 1.415 . . . . 0.0 113.747 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.151 1.781 . . . . 0.0 114.596 -177.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m 54.52 117.14 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.59 2.356 . . . . 0.0 115.45 -171.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -101.81 156.13 17.7 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.706 1.602 . . . . 0.0 112.042 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 76.7 mttt 39.35 61.94 1.24 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.168 1.787 . . . . 0.0 112.984 -171.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -53.83 141.63 46.71 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 124.469 1.108 . . . . 0.0 111.457 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -67.5 114.61 3.34 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.608 2.205 . . . . 0.0 109.787 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 51.65 54.96 10.09 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.554 1.542 . . . . 0.0 114.701 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.2 t -53.49 -34.9 59.77 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.522 -1.361 . . . . 0.0 114.613 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 15.9 tpt -59.98 -39.63 86.36 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.209 -0.932 . . . . 0.0 111.954 174.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.7 mt -79.35 -34.68 16.39 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.571 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -50.09 -39.28 42.04 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.965 1.711 . . . . 0.0 112.077 175.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -61.97 -40.89 97.16 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 170.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -71.6 -42.3 67.89 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.862 -1.149 . . . . 0.0 113.554 174.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.267 1.3 tt -64.23 -36.25 76.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-O 117.302 -1.332 . . . . 0.0 110.12 170.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -61.42 -29.7 70.1 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 122.21 2.277 . . . . 0.0 113.294 172.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.4 -58.28 6.91 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.325 0.966 . . . . 0.0 111.182 167.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -63.31 -36.67 84.47 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.84 -42.46 90.49 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 124.975 1.31 . . . . 0.0 110.282 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' CZ ' HD21 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.411 HD21 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -56.36 21.76 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.34 -44.23 79.84 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.281 1.032 . . . . 0.0 111.771 173.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -42.3 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 118.828 0.74 . . . . 0.0 112.103 -175.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -65.46 -43.01 91.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.474 1.51 . . . . 0.0 111.233 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -63.77 -39.78 95.09 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.329 1.052 . . . . 0.0 112.1 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -70.13 -35.62 74.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.453 1.101 . . . . 0.0 113.255 175.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -79.16 -71.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.913 0.779 . . . . 0.0 112.626 174.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.64 -25.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 130.56 3.544 . . . . 0.0 118.015 -169.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -64.25 -36.56 84.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 128.666 2.786 . . . . 0.0 113.645 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.0 mt -70.11 168.79 14.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.233 1.413 . . . . 0.0 110.92 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -80.61 162.91 24.02 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.89 -1.131 . . . . 0.0 112.71 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -52.82 -36.62 58.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.299 1.04 . . . . 0.0 112.91 166.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.07 -38.36 69.45 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.598 1.159 . . . . 0.0 111.363 177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.87 86.98 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.844 172.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.49 -38.04 81.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 117.102 -1.428 . . . . 0.0 112.437 172.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.37 -39.79 85.7 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 122.149 2.25 . . . . 0.0 112.839 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t -104.63 -30.82 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.1 21.19 5.33 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.101 1.76 . . . . 0.0 113.939 -173.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 130.469 3.508 . . . . 0.0 117.053 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 119.204 -0.427 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 p -76.99 161.57 28.25 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 119.321 0.964 . . . . 0.0 112.412 167.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -153.72 43.07 0.56 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.081 1.352 . . . . 0.0 113.021 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -122.86 86.4 2.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.169 1.788 . . . . 0.0 110.782 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.02 153.35 56.06 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.13 0.972 . . . . 0.0 111.933 176.249 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.13 -177.99 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.96 2.44 . . . . 0.0 111.876 171.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -70.89 35.69 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.204 1.801 . . . . 0.0 114.307 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.1 t -77.6 -34.96 53.28 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.432 1.893 . . . . 0.0 113.69 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.0 ttt -62.23 -39.2 92.03 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.271 -0.893 . . . . 0.0 111.299 174.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 mm -73.71 -29.88 27.65 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.156 174.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -39.97 39.3 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 121.191 1.814 . . . . 0.0 112.151 175.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -62.36 -40.38 96.24 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 171.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -72.75 -40.45 66.01 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.081 -1.012 . . . . 0.0 113.702 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.2 tt -64.2 -40.23 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 120.209 1.368 . . . . 0.0 109.948 171.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -57.22 -26.13 60.21 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 121.452 1.933 . . . . 0.0 114.009 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.05 -48.29 58.47 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 170.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -74.76 -36.71 62.57 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.026 -1.046 . . . . 0.0 113.33 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -29.28 70.33 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.853 1.261 . . . . 0.0 110.919 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.454 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -45.24 92.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -44.59 79.78 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.741 0.7 . . . . 0.0 110.75 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -41.04 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.478 0.581 . . . . 0.0 111.816 -176.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -62.1 -43.56 98.56 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.618 1.167 . . . . 0.0 110.93 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.5 mtp85 -68.46 -30.91 69.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.128 1.371 . . . . 0.0 113.381 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.0 -36.38 56.44 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.989 1.316 . . . . 0.0 113.295 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -56.82 5.98 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 118.845 -0.597 . . . . 0.0 110.032 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.274 3.1 p-10 20.66 51.5 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 129.563 3.145 . . . . 0.0 117.155 -172.155 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -138.72 -42.7 0.48 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.845 1.258 . . . . 0.0 114.127 -166.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 mt -87.28 -168.62 2.3 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.038 2.135 . . . . 0.0 109.542 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -75.82 161.89 28.62 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.306 -0.871 . . . . 0.0 112.314 168.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.2 mmt-85 -56.23 -37.05 69.18 Favored 'General case' 0 N--CA 1.482 1.173 0 O-C-N 120.894 -1.129 . . . . 0.0 112.225 166.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -64.16 -36.73 85.0 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.471 1.108 . . . . 0.0 112.079 176.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.82 94.58 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.332 -0.855 . . . . 0.0 111.477 174.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -42.99 97.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.309 -1.329 . . . . 0.0 111.957 168.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.58 -35.72 78.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 121.775 2.079 . . . . 0.0 112.546 178.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.454 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m -85.92 -35.05 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.0 mmt -97.5 46.63 1.02 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.441 1.896 . . . . 0.0 113.147 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 128.871 2.868 . . . . 0.0 116.056 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 ptp . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.3 m -148.07 -64.36 0.25 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.124 1.37 . . . . 0.0 112.475 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -131.81 -54.76 1.0 Allowed 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 126.756 2.022 . . . . 0.0 112.788 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.7 pttt -124.57 58.2 1.23 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.858 2.063 . . . . 0.0 110.538 -170.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -53.78 140.59 49.12 Favored Pre-proline 0 C--O 1.249 1.075 0 C-N-CA 126.24 1.816 . . . . 0.0 111.845 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.26 -175.3 1.92 Allowed 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.715 2.943 . . . . 0.0 111.738 169.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -56.62 -8.05 0.51 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.198 1.799 . . . . 0.0 114.233 172.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.1 t -50.94 -34.73 29.93 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.319 1.448 . . . . 0.0 113.928 172.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.15 -40.14 92.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.452 1.101 . . . . 0.0 111.449 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -74.84 -36.83 40.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.868 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -43.25 64.49 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 121.258 1.844 . . . . 0.0 111.643 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 m -59.46 -37.8 79.12 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.139 1.376 . . . . 0.0 114.396 170.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -45.92 64.99 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.746 1.619 . . . . 0.0 112.531 173.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.273 0.2 OUTLIER -62.76 -40.98 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 119.91 1.232 . . . . 0.0 108.967 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.74 -11.18 2.88 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.29 -45.5 9.99 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 120.4 1.455 . . . . 0.0 113.74 166.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -78.03 -38.44 44.68 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.526 -1.359 . . . . 0.0 114.368 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.72 -13.91 59.57 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.358 1.463 . . . . 0.0 110.698 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.436 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t -53.87 -34.86 60.66 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.2 tt -71.06 -56.82 5.32 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.037 0.935 . . . . 0.0 110.602 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 19.7 m -63.92 -35.64 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -60.96 -39.28 88.94 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.471 1.508 . . . . 0.0 110.515 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -41.16 96.42 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.968 0.907 . . . . 0.0 112.968 174.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -75.53 -33.92 60.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -98.98 29.22 3.93 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.919 2.088 . . . . 0.0 113.479 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -17.8 18.93 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.146 1.378 . . . . 0.0 114.296 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.81 -43.09 80.64 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.195 1.798 . . . . 0.0 111.95 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.99 157.49 36.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.038 1.335 . . . . 0.0 111.309 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -69.48 160.29 31.7 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 120.879 -1.138 . . . . 0.0 111.985 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -29.98 53.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.371 1.068 . . . . 0.0 113.735 168.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -69.07 -44.49 72.47 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.268 1.027 . . . . 0.0 111.731 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.87 -40.34 91.54 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.138 0.575 . . . . 0.0 110.906 175.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.59 -38.93 83.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.726 0 CA-C-O 117.552 -1.213 . . . . 0.0 111.86 172.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.84 -42.7 94.7 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.166 1.803 . . . . 0.0 111.436 175.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.436 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m -95.32 -32.05 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.5 mmt -96.22 24.61 5.55 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.751 2.02 . . . . 0.0 113.296 -177.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 130.847 3.659 . . . . 0.0 118.269 173.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 C--O 1.217 -0.62 0 CA-C-O 117.475 -1.25 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.457 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.489 -1.243 . . . . 0.0 112.011 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.488 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.488 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 C--O 1.218 -0.575 0 CA-C-O 117.384 -1.293 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 66' ' ' LEU . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.459 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 31' ' ' TYR . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.464 0.274 0 CA-C-O 119.055 -0.498 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.661 ' HB1' HD21 ' A' ' 69' ' ' LEU . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.467 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.407 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' O ' HD22 ' A' ' 69' ' ' LEU . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.661 HD21 ' HB1' ' A' ' 19' ' ' ALA . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.581 0 CA-C-O 117.685 -1.15 . . . . 0.0 110.687 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 40' ' ' PHE . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' HD12 ' A' ' 39' ' ' LEU . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.455 HD12 ' CE2' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 120.603 0.239 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 66' ' ' LEU . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' HD21 ' A' ' 69' ' ' LEU . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.651 ' CG ' HD22 ' A' ' 69' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.651 HD22 ' CG ' ' A' ' 35' ' ' TYR . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.456 ' CZ ' HD22 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.456 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.218 -0.554 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.435 ' CB ' HD11 ' A' ' 69' ' ' LEU . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.698 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.447 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.447 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptt? . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.1 p -69.94 123.17 20.83 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.189 -1.57 . . . . 0.0 111.222 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -166.81 -56.12 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.586 1.154 . . . . 0.0 112.266 173.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -76.42 165.2 25.16 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.279 1.431 . . . . 0.0 111.837 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.4 tttt -57.1 135.98 80.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 124.636 1.174 . . . . 0.0 110.559 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.85 46.06 1.43 Allowed 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.748 3.632 . . . . 0.0 113.486 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.9 -46.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.158 1.783 . . . . 0.0 111.411 175.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -60.0 -36.41 77.13 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 6.0 mmt -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.92 1.288 . . . . 0.0 112.717 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.5 mt -88.88 -35.25 7.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.239 -1.362 . . . . 0.0 110.588 176.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.56 -41.81 61.4 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.783 1.629 . . . . 0.0 111.556 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.06 -32.64 73.19 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 171.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -81.61 -41.57 21.29 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.817 -1.177 . . . . 0.0 113.514 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.265 3.1 tt -60.8 -33.39 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.421 . . . . 0.0 110.008 167.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -57.88 -19.88 32.71 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 121.632 2.015 . . . . 0.0 114.712 171.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.4 -45.89 9.61 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.628 1.103 . . . . 0.0 112.885 165.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -43.48 84.24 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.107 -0.996 . . . . 0.0 112.587 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.36 -31.85 72.88 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m -63.68 -14.18 49.78 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.91 -55.61 4.49 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.991 1.269 . . . . 0.0 110.359 169.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.6 m -67.84 -33.56 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 O-C-N 121.521 -0.737 . . . . 0.0 112.368 -177.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm -56.03 -44.53 78.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.903 1.281 . . . . 0.0 111.609 170.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.11 87.67 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.644 0.778 . . . . 0.0 112.222 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.09 -32.57 65.07 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -105.44 27.48 8.3 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.828 1.651 . . . . 0.0 112.909 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.63 -16.39 10.38 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.047 1.739 . . . . 0.0 113.637 172.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -52.97 -41.79 64.9 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.988 1.315 . . . . 0.0 113.174 164.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.4 mt -77.32 162.0 27.64 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.406 1.082 . . . . 0.0 111.413 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.74 160.04 31.11 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.372 -0.83 . . . . 0.0 112.191 173.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -53.77 -33.73 56.76 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.808 0.843 . . . . 0.0 113.218 166.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -65.97 -46.81 76.74 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.931 0.892 . . . . 0.0 112.123 174.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.4 96.99 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.12 0.568 . . . . 0.0 111.264 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -36.99 77.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 CA-C-O 117.288 -1.339 . . . . 0.0 112.699 174.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.12 -37.75 81.47 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 121.586 1.994 . . . . 0.0 111.846 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.39 -22.62 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 20.1 mtm -109.14 27.41 9.55 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -174.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 128.499 2.72 . . . . 0.0 116.303 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 m 52.4 177.19 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.299 1.44 . . . . 0.0 114.712 -161.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -85.36 156.44 20.88 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.429 1.492 . . . . 0.0 111.7 172.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 pttt -87.79 94.25 9.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.987 1.715 . . . . 0.0 111.236 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -59.01 126.82 82.5 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-O 117.896 -1.049 . . . . 0.0 111.217 177.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.49 44.56 1.41 Allowed 'Trans proline' 0 CA--C 1.55 1.279 1 C-N-CA 125.42 4.08 . . . . 0.0 114.008 -172.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.64 -61.17 0.15 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.319 1.448 . . . . 0.0 110.489 171.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -62.0 -36.83 82.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.142 0.977 . . . . 0.0 113.389 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 11.0 mmt -64.07 -24.54 67.74 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.105 0.962 . . . . 0.0 112.932 175.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.8 mt -93.08 -36.91 7.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 C-N-CA 124.994 1.317 . . . . 0.0 110.12 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -50.93 -43.05 60.05 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.425 1.49 . . . . 0.0 112.18 174.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 m -61.14 -34.21 74.64 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -46.02 44.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.389 1.076 . . . . 0.0 112.385 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.275 1.0 OUTLIER -62.48 -36.11 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.396 175.487 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.11 -21.77 14.21 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 121.24 1.837 . . . . 0.0 115.282 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.7 -43.34 18.62 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 119.856 1.207 . . . . 0.0 113.236 167.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -39.03 61.42 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.758 -1.214 . . . . 0.0 112.836 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -63.92 -30.66 71.72 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.749 1.619 . . . . 0.0 110.837 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.4 tp-100 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.457 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -49.21 76.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -45.3 93.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.286 0.635 . . . . 0.0 110.744 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -39.64 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.52 -40.87 96.42 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.649 1.58 . . . . 0.0 111.501 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 -66.48 -28.15 68.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.401 1.08 . . . . 0.0 112.867 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -83.17 -41.87 17.96 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 7.3 m170 -103.48 48.71 0.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.308 1.843 . . . . 0.0 110.855 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -81.42 -2.19 48.55 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.042 -1.036 . . . . 0.0 113.415 173.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -62.55 -17.87 60.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.569 1.548 . . . . 0.0 113.953 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pp -111.43 165.68 11.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.262 2.225 . . . . 0.0 111.529 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -63.53 148.47 48.66 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.022 0.529 . . . . 0.0 111.41 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 -53.25 -32.32 47.84 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.235 -0.916 . . . . 0.0 112.395 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -61.39 -39.97 92.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.817 0.847 . . . . 0.0 112.736 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.25 -35.28 73.69 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.284 170.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.84 -37.23 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 120.03 1.287 . . . . 0.0 112.012 171.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -68.15 -42.35 80.24 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 121.008 1.731 . . . . 0.0 111.881 176.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -81.07 -14.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 17.3 ptm -136.25 47.38 2.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.827 1.651 . . . . 0.0 112.805 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.0 pttp . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.532 1.933 . . . . 0.0 115.174 -179.707 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.327 0.108 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 50.7 t -137.73 -53.82 0.66 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.904 1.282 . . . . 0.0 111.419 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -68.68 166.6 16.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.474 1.51 . . . . 0.0 111.648 165.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt 56.74 171.55 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 126.724 2.01 . . . . 0.0 114.181 -169.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -61.15 147.51 86.46 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 123.874 0.87 . . . . 0.0 110.923 175.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -68.45 128.08 16.69 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 122.402 2.068 . . . . 0.0 111.539 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 56.16 35.97 26.61 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 127.355 2.262 . . . . 0.0 116.301 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.9 t -53.24 -37.73 62.35 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -33.05 72.99 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 120.991 -1.068 . . . . 0.0 112.332 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.2 mt -84.59 -35.32 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 117.413 -1.279 . . . . 0.0 110.093 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.74 -42.42 46.2 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 121.209 1.822 . . . . 0.0 112.734 174.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 m -58.38 -39.56 79.95 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.962 -1.086 . . . . 0.0 113.831 171.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -75.73 -38.31 58.61 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.504 1.047 . . . . 0.0 112.791 173.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.254 0.5 OUTLIER -61.96 -44.96 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 120.155 1.343 . . . . 0.0 109.266 174.821 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 15.2 mm-40 -59.16 -28.25 66.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.807 1.185 . . . . 0.0 113.372 177.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.06 -48.31 63.1 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 120.152 1.342 . . . . 0.0 113.809 170.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -84.79 -29.79 25.13 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 121.147 -0.971 . . . . 0.0 113.612 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -24.94 63.24 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.324 1.849 . . . . 0.0 112.011 165.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.488 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.33 -19.24 63.12 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.98 -45.33 13.24 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.229 1.011 . . . . 0.0 110.202 166.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -62.44 -41.9 93.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -19.88 65.91 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.885 1.274 . . . . 0.0 114.262 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -84.34 -42.11 16.09 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.261 1.025 . . . . 0.0 112.459 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.24 -28.34 63.09 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.11 0.868 . . . . 0.0 113.055 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -114.68 36.59 3.75 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.386 2.274 . . . . 0.0 111.185 176.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -57.39 -14.79 5.2 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -54.21 -39.06 66.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.719 2.008 . . . . 0.0 112.761 167.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 47.2 mt -78.66 143.59 36.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.845 1.258 . . . . 0.0 110.46 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.49 160.27 14.01 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 121.347 -0.845 . . . . 0.0 112.624 171.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -57.67 -33.12 68.01 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.566 -0.709 . . . . 0.0 112.572 173.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -66.72 -43.82 83.23 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.685 0.794 . . . . 0.0 111.871 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.87 96.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.536 0.734 . . . . 0.0 111.063 170.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -35.67 72.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 117.384 -1.293 . . . . 0.0 112.738 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -66.83 -44.57 80.77 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.347 1.885 . . . . 0.0 112.091 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 15' ' ' GLU . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.488 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.23 -26.84 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.0 mmt -90.65 23.77 2.93 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 128.147 2.579 . . . . 0.0 112.828 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.9 mttt . . . . . 0 C--O 1.255 1.346 0 C-N-CA 126.998 2.119 . . . . 0.0 111.583 -179.785 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ptp . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 119.732 -0.175 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.5 t 47.0 74.13 0.16 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.774 2.03 . . . . 0.0 114.329 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -46.76 0.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -173.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.82 26.01 3.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.847 1.659 . . . . 0.0 113.21 -176.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -55.02 150.31 20.32 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.141 1.376 . . . . 0.0 112.809 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.35 -17.92 30.35 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 113.374 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -145.77 107.58 4.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.511 1.924 . . . . 0.0 108.489 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.6 t -122.03 -32.91 3.63 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.755 1.222 . . . . 0.0 112.697 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.2 mmt -58.36 -31.4 67.58 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.316 1.046 . . . . 0.0 112.656 170.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.1 mt -94.42 -27.95 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.226 175.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.9 tp -53.69 -40.07 65.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 121.107 1.776 . . . . 0.0 112.476 175.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 m -59.5 -38.14 80.12 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.97 0.908 . . . . 0.0 112.887 172.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -76.48 -38.39 55.4 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.318 -0.864 . . . . 0.0 112.882 174.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -65.06 -37.41 80.15 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 CA-C-N 119.828 1.195 . . . . 0.0 109.79 172.463 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -60.33 -28.34 68.07 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 120.357 1.435 . . . . 0.0 113.477 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.5 -53.46 23.09 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.328 0.967 . . . . 0.0 112.135 169.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 pttt -73.69 -32.16 63.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -71.52 -36.45 71.04 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 126.161 1.784 . . . . 0.0 110.242 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 66' ' ' LEU . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.459 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t -54.23 -40.06 67.33 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.93 -40.3 60.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.416 1.486 . . . . 0.0 112.395 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.3 -36.12 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.506 -0.746 . . . . 0.0 112.156 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -60.94 -37.26 81.72 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.739 2.016 . . . . 0.0 112.336 173.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -65.02 -31.77 73.17 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.088 0.955 . . . . 0.0 113.209 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -81.02 -16.03 54.49 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.408 ' CD2' HG12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -85.59 -5.17 59.3 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.88 1.272 . . . . 0.0 113.677 177.287 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -47.0 -22.76 0.37 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -170.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.24 2.216 . . . . 0.0 114.393 168.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.59 -170.14 2.51 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 128.933 2.893 . . . . 0.0 110.031 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -107.11 151.36 25.48 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.44 -1.413 . . . . 0.0 111.782 173.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.16 -29.23 1.47 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.99 -33.96 70.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.518 1.127 . . . . 0.0 112.644 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.18 -36.68 77.58 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.394 1.077 . . . . 0.0 111.539 167.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.408 HG12 ' CD2' ' A' ' 51' ' ' HIS . 0.3 OUTLIER -62.24 -43.43 97.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 CA-C-N 120.356 1.434 . . . . 0.0 111.553 168.156 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -60.6 -28.04 68.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 121.787 2.085 . . . . 0.0 112.441 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 31' ' ' TYR . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m -96.21 -24.38 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 6.5 ptm -118.84 15.74 13.47 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -173.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.2 mttt . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 128.395 2.678 . . . . 0.0 114.913 -173.383 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.3 p -140.5 41.48 1.89 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.566 1.546 . . . . 0.0 111.397 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -48.81 157.32 0.4 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.882 1.273 . . . . 0.0 112.164 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.18 118.4 2.12 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.311 0.644 . . . . 0.0 110.325 176.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -75.61 138.37 70.51 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 118.158 -0.925 . . . . 0.0 108.631 -175.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -68.17 -177.65 1.45 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.435 2.09 . . . . 0.0 111.416 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -68.3 33.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 126.156 1.783 . . . . 0.0 114.856 -176.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.3 t -73.48 -35.47 65.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.942 2.097 . . . . 0.0 113.731 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.8 mmt -58.46 -34.25 70.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.168 0.987 . . . . 0.0 111.892 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.0 mt -85.78 -41.92 15.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 CA-C-O 117.334 -1.317 . . . . 0.0 110.671 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.44 -39.36 57.23 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 120.99 1.723 . . . . 0.0 112.146 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -62.2 -39.48 92.9 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.179 0.992 . . . . 0.0 113.651 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -74.69 -34.23 62.59 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.119 -0.988 . . . . 0.0 113.169 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -36.94 78.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.682 0 CA-C-N 120.442 1.474 . . . . 0.0 109.591 172.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -59.25 -13.89 9.27 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.708 1.14 . . . . 0.0 113.902 173.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.07 -46.82 14.41 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.074 1.306 . . . . 0.0 113.206 165.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -83.35 -39.68 20.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -71.73 -19.54 62.03 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.267 1.827 . . . . 0.0 111.836 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.661 ' HB1' HD21 ' A' ' 69' ' ' LEU . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.467 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.407 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m -58.21 -28.57 64.95 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 tt -71.04 -60.16 2.38 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.767 1.167 . . . . 0.0 110.653 174.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.4 HG21 HD23 ' A' ' 66' ' ' LEU . 11.2 m -63.43 -32.63 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -61.85 -48.51 80.22 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.951 1.3 . . . . 0.0 111.437 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -62.6 -39.3 93.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.135 0.974 . . . . 0.0 112.216 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.28 -36.42 74.38 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -75.51 0.13 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.11 0.868 . . . . 0.0 110.887 171.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.8 t70 39.62 36.25 0.23 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.405 1.882 . . . . 0.0 113.835 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -134.04 -47.66 0.79 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.587 1.555 . . . . 0.0 111.862 -165.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.5 mt -69.58 170.81 9.96 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.74 1.216 . . . . 0.0 110.654 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -63.36 157.73 22.29 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.194 -0.941 . . . . 0.0 112.794 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.61 -36.94 62.52 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 121.282 -0.887 . . . . 0.0 112.688 167.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -34.79 76.07 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.401 1.081 . . . . 0.0 112.123 176.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.71 84.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.948 173.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.71 -40.93 90.87 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.689 172.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.54 -39.31 88.52 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.276 1.853 . . . . 0.0 112.804 176.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' O ' HD22 ' A' ' 69' ' ' LEU . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HG21 ' A' ' 47' ' ' VAL . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.661 HD21 ' HB1' ' A' ' 19' ' ' ALA . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m -92.81 -32.5 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 mtp -88.48 50.18 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.077 2.151 . . . . 0.0 111.149 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.0 tttp . . . . . 0 C--O 1.256 1.405 0 C-N-CA 128.003 2.521 . . . . 0.0 114.603 171.27 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -57.06 166.28 1.09 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.675 0.79 . . . . 0.0 112.549 166.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 58.49 -70.33 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 127.407 2.283 . . . . 0.0 113.926 -171.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.57 63.86 4.12 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.077 2.151 . . . . 0.0 110.521 175.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -59.89 146.43 81.86 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 111.556 172.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.73 -14.55 30.06 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.273 2.649 . . . . 0.0 112.412 176.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -125.57 125.86 43.86 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.281 1.432 . . . . 0.0 110.184 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -131.37 -42.39 1.06 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.506 . . . . 0.0 111.103 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -49.39 74.68 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.04 1.336 . . . . 0.0 111.541 171.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -80.06 -32.95 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 116.992 -1.48 . . . . 0.0 110.896 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -51.94 -41.31 61.95 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.141 1.792 . . . . 0.0 111.658 174.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -60.6 -38.51 84.88 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 170.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -73.08 -42.68 62.75 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.804 -1.185 . . . . 0.0 113.696 174.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.296 0.8 OUTLIER -59.66 -43.05 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-O 116.793 -1.575 . . . . 0.0 109.273 170.289 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.76 -17.56 9.49 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 121.74 2.064 . . . . 0.0 114.858 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -90.54 -43.85 9.95 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.481 1.037 . . . . 0.0 112.977 168.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -43.35 89.65 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 119.501 1.046 . . . . 0.0 111.854 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -30.93 64.3 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 125.094 1.358 . . . . 0.0 110.687 177.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 40' ' ' PHE . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' HD12 ' A' ' 39' ' ' LEU . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.455 HD12 ' CE2' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t -59.67 -31.91 69.98 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tt -81.94 -38.3 25.44 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.083 1.353 . . . . 0.0 112.056 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -37.52 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 O-C-N 120.865 -1.147 . . . . 0.0 112.72 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -48.27 82.53 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.909 1.283 . . . . 0.0 111.715 176.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -64.92 -34.68 78.98 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -72.86 -35.3 67.17 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m80 -119.86 62.47 0.83 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.485 1.914 . . . . 0.0 110.067 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -92.02 10.55 28.59 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.858 1.663 . . . . 0.0 112.02 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -64.03 -18.71 64.6 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.849 1.66 . . . . 0.0 113.721 176.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.7 165.47 17.88 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.67 2.388 . . . . 0.0 111.058 -177.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 -63.02 160.85 14.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.629 0.772 . . . . 0.0 112.226 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 52.8 mtm-85 -56.26 -31.88 63.99 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.145 -0.972 . . . . 0.0 112.721 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.28 -39.05 93.49 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.96 0.904 . . . . 0.0 112.33 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.55 -38.59 84.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.422 -0.799 . . . . 0.0 111.188 172.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -39.09 84.33 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.371 170.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.12 -36.52 83.38 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.177 1.808 . . . . 0.0 111.361 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 66' ' ' LEU . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m -88.35 -35.07 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.2 ptm -86.06 19.14 2.73 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.799 1.64 . . . . 0.0 112.3 179.221 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tpp . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.666 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t 59.48 179.44 0.08 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 125.485 1.514 . . . . 0.0 112.828 -168.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 42.77 94.92 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.744 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mttt 67.06 108.13 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.575 2.35 . . . . 0.0 111.55 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -59.52 149.04 72.15 Favored Pre-proline 0 N--CA 1.472 0.652 0 C-N-CA 124.019 0.928 . . . . 0.0 111.614 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -74.99 71.04 5.13 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.962 3.108 . . . . 0.0 111.892 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 59.51 103.79 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.697 2.799 . . . . 0.0 113.565 -176.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.2 t -52.77 -34.84 54.95 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.499 -1.376 . . . . 0.0 114.106 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtp -62.74 -28.19 69.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.41 1.484 . . . . 0.0 113.116 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -94.54 -33.04 4.81 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.373 173.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.38 -41.47 60.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 121.176 1.807 . . . . 0.0 111.763 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.76 -37.0 80.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 171.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -75.29 -41.39 57.19 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.079 -1.013 . . . . 0.0 113.458 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.1 tt -62.25 -41.66 92.32 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 CA-C-N 120.323 1.419 . . . . 0.0 109.557 170.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.91 -22.09 13.75 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.118 1.781 . . . . 0.0 114.557 173.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.13 -46.97 26.14 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.756 1.162 . . . . 0.0 113.257 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -77.54 -38.28 49.0 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.68 -19.47 62.07 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 126.084 1.754 . . . . 0.0 111.392 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' HD21 ' A' ' 69' ' ' LEU . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.651 ' CG ' HD22 ' A' ' 69' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.55 -28.15 66.86 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.62 -45.48 13.43 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.057 0.943 . . . . 0.0 111.386 171.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -65.5 -33.73 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -62.89 -29.94 71.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.685 1.594 . . . . 0.0 111.686 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -66.82 -33.31 75.33 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.971 -1.081 . . . . 0.0 111.98 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -76.69 12.86 1.15 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.995 1.718 . . . . 0.0 114.03 165.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.37 6.37 11.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.907 1.683 . . . . 0.0 112.607 172.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -28.31 1.77 Allowed 'General case' 0 CA--C 1.553 1.095 0 O-C-N 120.405 -1.434 . . . . 0.0 114.724 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -94.19 -17.94 22.22 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.412 1.885 . . . . 0.0 115.096 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 77.1 mt -82.54 -179.02 7.29 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.537 1.935 . . . . 0.0 111.985 172.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -97.24 156.49 16.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.438 1.495 . . . . 0.0 112.487 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -53.8 -41.37 67.22 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.26 -0.9 . . . . 0.0 112.241 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.56 -37.11 86.05 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.637 0.775 . . . . 0.0 112.956 172.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.96 95.54 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.957 0.799 . . . . 0.0 111.431 173.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.78 -45.68 83.92 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-O 116.799 -1.572 . . . . 0.0 112.095 169.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.21 -33.48 73.55 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 122.228 2.286 . . . . 0.0 112.278 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.651 HD22 ' CG ' ' A' ' 35' ' ' TYR . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.18 -36.07 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.7 ptm -85.03 3.65 37.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.238 1.415 . . . . 0.0 113.747 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.151 1.781 . . . . 0.0 114.596 -177.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m 54.52 117.14 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.59 2.356 . . . . 0.0 115.45 -171.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -101.81 156.13 17.7 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.706 1.602 . . . . 0.0 112.042 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 76.7 mttt 39.35 61.94 1.24 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.168 1.787 . . . . 0.0 112.984 -171.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -53.83 141.63 46.71 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 124.469 1.108 . . . . 0.0 111.457 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -67.5 114.61 3.34 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.608 2.205 . . . . 0.0 109.787 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 51.65 54.96 10.09 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.554 1.542 . . . . 0.0 114.701 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.2 t -53.49 -34.9 59.77 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.522 -1.361 . . . . 0.0 114.613 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 15.9 tpt -59.98 -39.63 86.36 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.209 -0.932 . . . . 0.0 111.954 174.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.7 mt -79.35 -34.68 16.39 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.571 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -50.09 -39.28 42.04 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.965 1.711 . . . . 0.0 112.077 175.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -61.97 -40.89 97.16 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 170.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -71.6 -42.3 67.89 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.862 -1.149 . . . . 0.0 113.554 174.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.267 1.3 tt -64.23 -36.25 76.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-O 117.302 -1.332 . . . . 0.0 110.12 170.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -61.42 -29.7 70.1 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 122.21 2.277 . . . . 0.0 113.294 172.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.4 -58.28 6.91 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.325 0.966 . . . . 0.0 111.182 167.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -63.31 -36.67 84.47 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.84 -42.46 90.49 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 124.975 1.31 . . . . 0.0 110.282 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.456 ' CZ ' HD22 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.456 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -56.36 21.76 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.34 -44.23 79.84 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.281 1.032 . . . . 0.0 111.771 173.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -42.3 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 118.828 0.74 . . . . 0.0 112.103 -175.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -65.46 -43.01 91.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.474 1.51 . . . . 0.0 111.233 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -63.77 -39.78 95.09 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.329 1.052 . . . . 0.0 112.1 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -70.13 -35.62 74.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.453 1.101 . . . . 0.0 113.255 175.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -79.16 -71.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.913 0.779 . . . . 0.0 112.626 174.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.64 -25.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 130.56 3.544 . . . . 0.0 118.015 -169.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -64.25 -36.56 84.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 128.666 2.786 . . . . 0.0 113.645 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.0 mt -70.11 168.79 14.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.233 1.413 . . . . 0.0 110.92 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -80.61 162.91 24.02 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.89 -1.131 . . . . 0.0 112.71 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -52.82 -36.62 58.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.299 1.04 . . . . 0.0 112.91 166.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.07 -38.36 69.45 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.598 1.159 . . . . 0.0 111.363 177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.87 86.98 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.844 172.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.49 -38.04 81.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 117.102 -1.428 . . . . 0.0 112.437 172.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.37 -39.79 85.7 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 122.149 2.25 . . . . 0.0 112.839 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t -104.63 -30.82 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.1 21.19 5.33 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.101 1.76 . . . . 0.0 113.939 -173.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 130.469 3.508 . . . . 0.0 117.053 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 119.204 -0.427 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 p -76.99 161.57 28.25 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 119.321 0.964 . . . . 0.0 112.412 167.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -153.72 43.07 0.56 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.081 1.352 . . . . 0.0 113.021 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -122.86 86.4 2.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.169 1.788 . . . . 0.0 110.782 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.02 153.35 56.06 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.13 0.972 . . . . 0.0 111.933 176.249 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.13 -177.99 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.96 2.44 . . . . 0.0 111.876 171.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -70.89 35.69 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.204 1.801 . . . . 0.0 114.307 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.1 t -77.6 -34.96 53.28 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.432 1.893 . . . . 0.0 113.69 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.0 ttt -62.23 -39.2 92.03 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.271 -0.893 . . . . 0.0 111.299 174.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 mm -73.71 -29.88 27.65 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.156 174.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -39.97 39.3 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 121.191 1.814 . . . . 0.0 112.151 175.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -62.36 -40.38 96.24 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 171.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -72.75 -40.45 66.01 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.081 -1.012 . . . . 0.0 113.702 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.2 tt -64.2 -40.23 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 120.209 1.368 . . . . 0.0 109.948 171.246 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -57.22 -26.13 60.21 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 121.452 1.933 . . . . 0.0 114.009 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.05 -48.29 58.47 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 170.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -74.76 -36.71 62.57 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.026 -1.046 . . . . 0.0 113.33 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -29.28 70.33 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.853 1.261 . . . . 0.0 110.919 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.435 ' CB ' HD11 ' A' ' 69' ' ' LEU . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.433 ' HZ ' HD11 ' A' ' 54' ' ' LEU . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -45.24 92.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -44.59 79.78 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.741 0.7 . . . . 0.0 110.75 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -41.04 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.478 0.581 . . . . 0.0 111.816 -176.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -62.1 -43.56 98.56 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.618 1.167 . . . . 0.0 110.93 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.5 mtp85 -68.46 -30.91 69.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.128 1.371 . . . . 0.0 113.381 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.0 -36.38 56.44 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.989 1.316 . . . . 0.0 113.295 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.439 ' CD2' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -70.02 -56.82 5.98 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 118.845 -0.597 . . . . 0.0 110.032 175.329 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.274 3.1 p-10 20.66 51.5 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 129.563 3.145 . . . . 0.0 117.155 -172.155 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -138.72 -42.7 0.48 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.845 1.258 . . . . 0.0 114.127 -166.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.439 HD12 ' CD2' ' A' ' 51' ' ' HIS . 2.1 mt -87.28 -168.62 2.3 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.038 2.135 . . . . 0.0 109.542 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -75.82 161.89 28.62 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.306 -0.871 . . . . 0.0 112.314 168.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.2 mmt-85 -56.23 -37.05 69.18 Favored 'General case' 0 N--CA 1.482 1.173 0 O-C-N 120.894 -1.129 . . . . 0.0 112.225 166.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -64.16 -36.73 85.0 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.471 1.108 . . . . 0.0 112.079 176.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.82 94.58 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.332 -0.855 . . . . 0.0 111.477 174.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -42.99 97.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.309 -1.329 . . . . 0.0 111.957 168.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.58 -35.72 78.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 121.775 2.079 . . . . 0.0 112.546 178.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m -85.92 -35.05 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.0 mmt -97.5 46.63 1.02 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.441 1.896 . . . . 0.0 113.147 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 128.871 2.868 . . . . 0.0 116.056 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 ptp . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.3 m -148.07 -64.36 0.25 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.124 1.37 . . . . 0.0 112.475 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -131.81 -54.76 1.0 Allowed 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 126.756 2.022 . . . . 0.0 112.788 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.7 pttt -124.57 58.2 1.23 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.858 2.063 . . . . 0.0 110.538 -170.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -53.78 140.59 49.12 Favored Pre-proline 0 C--O 1.249 1.075 0 C-N-CA 126.24 1.816 . . . . 0.0 111.845 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.26 -175.3 1.92 Allowed 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.715 2.943 . . . . 0.0 111.738 169.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -56.62 -8.05 0.51 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.198 1.799 . . . . 0.0 114.233 172.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.1 t -50.94 -34.73 29.93 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.319 1.448 . . . . 0.0 113.928 172.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.15 -40.14 92.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.452 1.101 . . . . 0.0 111.449 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -74.84 -36.83 40.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.868 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -43.25 64.49 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 121.258 1.844 . . . . 0.0 111.643 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 m -59.46 -37.8 79.12 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.139 1.376 . . . . 0.0 114.396 170.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -45.92 64.99 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.746 1.619 . . . . 0.0 112.531 173.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.273 0.2 OUTLIER -62.76 -40.98 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 119.91 1.232 . . . . 0.0 108.967 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.74 -11.18 2.88 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.29 -45.5 9.99 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 120.4 1.455 . . . . 0.0 113.74 166.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -78.03 -38.44 44.68 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.526 -1.359 . . . . 0.0 114.368 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.72 -13.91 59.57 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.358 1.463 . . . . 0.0 110.698 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.447 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t -53.87 -34.86 60.66 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.2 tt -71.06 -56.82 5.32 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.037 0.935 . . . . 0.0 110.602 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 19.7 m -63.92 -35.64 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -60.96 -39.28 88.94 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.471 1.508 . . . . 0.0 110.515 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -41.16 96.42 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.968 0.907 . . . . 0.0 112.968 174.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -75.53 -33.92 60.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -98.98 29.22 3.93 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.919 2.088 . . . . 0.0 113.479 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -17.8 18.93 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.146 1.378 . . . . 0.0 114.296 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.81 -43.09 80.64 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.195 1.798 . . . . 0.0 111.95 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.99 157.49 36.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.038 1.335 . . . . 0.0 111.309 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -69.48 160.29 31.7 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 120.879 -1.138 . . . . 0.0 111.985 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -29.98 53.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.371 1.068 . . . . 0.0 113.735 168.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -69.07 -44.49 72.47 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.268 1.027 . . . . 0.0 111.731 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.87 -40.34 91.54 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.138 0.575 . . . . 0.0 110.906 175.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.59 -38.93 83.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.726 0 CA-C-O 117.552 -1.213 . . . . 0.0 111.86 172.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.84 -42.7 94.7 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.166 1.803 . . . . 0.0 111.436 175.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.447 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m -95.32 -32.05 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.5 mmt -96.22 24.61 5.55 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.751 2.02 . . . . 0.0 113.296 -177.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 130.847 3.659 . . . . 0.0 118.269 173.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 . . . . . 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 . . . . . 0 N--CA 1.471 0.59 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m . . . . . 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 . . . . . 0 C--O 1.217 -0.62 0 CA-C-O 117.475 -1.25 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.457 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.489 -1.243 . . . . 0.0 112.011 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.488 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 . . . . . 0 N--CA 1.474 0.753 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.488 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 C--O 1.218 -0.575 0 CA-C-O 117.384 -1.293 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 66' ' ' LEU . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.459 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 CA--C 1.544 0.719 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 31' ' ' TYR . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m . . . . . 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 . . . . . 0 N--CA 1.464 0.274 0 CA-C-O 119.055 -0.498 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.661 ' HB1' HD21 ' A' ' 69' ' ' LEU . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.467 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.407 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.408 ' O ' HD22 ' A' ' 69' ' ' LEU . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.661 HD21 ' HB1' ' A' ' 19' ' ' ALA . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.218 -0.581 0 CA-C-O 117.685 -1.15 . . . . 0.0 110.687 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 40' ' ' PHE . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' HD12 ' A' ' 39' ' ' LEU . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.455 HD12 ' CE2' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t . . . . . 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 . . . . . 0 N--CA 1.472 0.639 0 CA-C-O 120.603 0.239 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 66' ' ' LEU . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.169 -0.92 . . . . 0.0 111.392 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' HD21 ' A' ' 69' ' ' LEU . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.651 ' CG ' HD22 ' A' ' 69' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 112.278 0.474 . . . . 0.0 112.278 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.651 HD22 ' CG ' ' A' ' 35' ' ' TYR . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.456 ' CZ ' HD22 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.456 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.218 -0.554 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.435 ' CB ' HD11 ' A' ' 69' ' ' LEU . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 . . . . . 0 N--CA 1.474 0.748 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 117.943 -1.027 . . . . 0.0 110.698 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.447 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 . . . . . 0 N--CA 1.473 0.704 0 N-CA-C 111.436 0.162 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.447 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m . . . . . 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.7 ptt? . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 113.199 0.815 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 11.1 p -69.94 123.17 20.83 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.189 -1.57 . . . . 0.0 111.222 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -166.81 -56.12 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.586 1.154 . . . . 0.0 112.266 173.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -76.42 165.2 25.16 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.279 1.431 . . . . 0.0 111.837 174.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.4 tttt -57.1 135.98 80.56 Favored Pre-proline 0 CA--C 1.545 0.785 0 C-N-CA 124.636 1.174 . . . . 0.0 110.559 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -74.85 46.06 1.43 Allowed 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 124.748 3.632 . . . . 0.0 113.486 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.9 -46.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.158 1.783 . . . . 0.0 111.411 175.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -60.0 -36.41 77.13 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.929 1.085 . . . . 0.0 113.929 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 6.0 mmt -57.36 -33.65 68.01 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.92 1.288 . . . . 0.0 112.717 172.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.5 mt -88.88 -35.25 7.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.39 0 CA-C-O 117.239 -1.362 . . . . 0.0 110.588 176.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.56 -41.81 61.4 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 120.783 1.629 . . . . 0.0 111.556 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.06 -32.64 73.19 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 171.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -81.61 -41.57 21.29 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 120.817 -1.177 . . . . 0.0 113.514 174.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.265 3.1 tt -60.8 -33.39 55.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 120.327 1.421 . . . . 0.0 110.008 167.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -57.88 -19.88 32.71 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 121.632 2.015 . . . . 0.0 114.712 171.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.4 -45.89 9.61 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.628 1.103 . . . . 0.0 112.885 165.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -43.48 84.24 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 121.107 -0.996 . . . . 0.0 112.587 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.36 -31.85 72.88 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 117.667 -1.158 . . . . 0.0 110.798 172.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.55 -41.92 92.46 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 120.557 1.526 . . . . 0.0 110.398 171.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.0 t -56.86 -51.72 67.94 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.867 1.212 . . . . 0.0 112.3 172.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -66.24 -40.36 90.17 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 55.7 t90 -67.63 -53.67 26.07 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 125.781 1.632 . . . . 0.0 111.329 177.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.5 mt -58.77 -45.09 90.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.596 0.759 . . . . 0.0 109.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -60.45 -48.06 83.39 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.55 1.14 . . . . 0.0 113.609 174.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -70.25 -32.95 71.02 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.0 m -72.14 -49.31 36.93 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.647 1.579 . . . . 0.0 111.789 177.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.19 16.74 0.07 OUTLIER Glycine 0 CA--C 1.539 1.555 0 N-CA-C 117.379 1.711 . . . . 0.0 117.379 178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -140.93 56.0 6.15 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 125.533 1.533 . . . . 0.0 114.376 -167.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -59.84 -19.08 52.73 Favored 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.262 1.975 . . . . 0.0 114.072 -178.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.8 tp60 -65.4 -40.01 92.92 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.642 1.577 . . . . 0.0 114.226 173.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -65.61 -36.82 84.83 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 120.114 1.324 . . . . 0.0 112.488 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.72 -47.15 86.57 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.01 0.524 . . . . 0.0 110.995 170.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.61 -40.47 79.2 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.7 0.8 . . . . 0.0 112.686 177.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.86 -37.07 85.4 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.272 1.029 . . . . 0.0 113.423 178.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -77.62 -42.93 33.19 Favored 'General case' 0 N--CA 1.468 0.448 0 O-C-N 121.371 -0.831 . . . . 0.0 112.421 171.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -64.12 -17.25 63.27 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.376 0.671 . . . . 0.0 112.576 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -64.57 -59.89 3.76 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.657 1.583 . . . . 0.0 112.226 169.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -164.78 29.57 0.06 Allowed 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -175.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 49.3 80.95 0.06 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 126.19 1.796 . . . . 0.0 112.04 -172.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.6 119.95 79.46 Favored Pre-proline 0 CA--C 1.557 1.248 0 C-N-CA 125.06 1.344 . . . . 0.0 114.347 -176.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -92.42 75.51 0.46 Allowed 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 123.444 2.763 . . . . 0.0 112.479 -177.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -83.84 162.47 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 121.31 -0.869 . . . . 0.0 111.464 177.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -87.8 129.39 35.2 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.317 0.647 . . . . 0.0 109.938 168.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.29 -35.43 36.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 O-C-N 121.542 -0.724 . . . . 0.0 111.578 171.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.8 m -63.68 -14.18 49.78 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -81.91 -55.61 4.49 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.991 1.269 . . . . 0.0 110.359 169.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 5.6 m -67.84 -33.56 62.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 O-C-N 121.521 -0.737 . . . . 0.0 112.368 -177.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.0 ttmm -56.03 -44.53 78.86 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.903 1.281 . . . . 0.0 111.609 170.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -40.11 87.67 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.644 0.778 . . . . 0.0 112.222 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -73.09 -32.57 65.07 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -105.44 27.48 8.3 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.828 1.651 . . . . 0.0 112.909 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -57.63 -16.39 10.38 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 126.047 1.739 . . . . 0.0 113.637 172.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -52.97 -41.79 64.9 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.988 1.315 . . . . 0.0 113.174 164.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.4 mt -77.32 162.0 27.64 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.406 1.082 . . . . 0.0 111.413 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.74 160.04 31.11 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.372 -0.83 . . . . 0.0 112.191 173.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 ptt180 -53.77 -33.73 56.76 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.808 0.843 . . . . 0.0 113.218 166.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -65.97 -46.81 76.74 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.931 0.892 . . . . 0.0 112.123 174.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.35 -41.4 96.99 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.12 0.568 . . . . 0.0 111.264 174.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.07 -36.99 77.51 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 CA-C-O 117.288 -1.339 . . . . 0.0 112.699 174.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -68.12 -37.75 81.47 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 121.586 1.994 . . . . 0.0 111.846 175.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.61 -46.57 72.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.895 0.878 . . . . 0.0 111.898 175.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 39.6 tp -62.57 -45.72 91.64 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.58 1.152 . . . . 0.0 111.415 172.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.0 t -54.66 -35.69 63.8 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 125.738 1.615 . . . . 0.0 111.256 171.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -57.85 -42.99 85.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 121.586 1.994 . . . . 0.0 112.493 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -78.6 -52.21 8.79 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 118.493 -0.765 . . . . 0.0 110.939 175.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.4 mt -57.69 -46.65 84.05 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-O 117.451 -1.261 . . . . 0.0 113.021 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.44 -46.75 80.15 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 121.584 1.993 . . . . 0.0 111.165 172.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.2 m -55.97 -43.01 77.14 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 119.318 0.963 . . . . 0.0 112.68 174.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 72.7 mt -69.76 -51.82 30.67 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.186 0.994 . . . . 0.0 111.709 176.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.4 m-20 -58.4 -28.14 64.93 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.1 2.16 . . . . 0.0 112.972 175.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -71.87 -55.63 7.19 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 126.573 1.949 . . . . 0.0 111.234 174.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 81.2 m -63.31 -25.53 68.35 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.855 0.752 . . . . 0.0 111.946 173.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.65 -40.61 95.75 Favored 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 114.557 1.317 . . . . 0.0 114.557 172.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 28.3 m -80.39 -22.62 11.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 CA-C-N 119.545 1.066 . . . . 0.0 113.013 170.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 20.1 mtm -109.14 27.41 9.55 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.934 1.457 . . . . 0.0 114.934 -174.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.432 0 C-N-CA 128.499 2.72 . . . . 0.0 116.303 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 m 52.4 177.19 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.299 1.44 . . . . 0.0 114.712 -161.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 mtm180 -85.36 156.44 20.88 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.429 1.492 . . . . 0.0 111.7 172.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.1 pttt -87.79 94.25 9.7 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.987 1.715 . . . . 0.0 111.236 178.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 25.2 mttm -59.01 126.82 82.5 Favored Pre-proline 0 N--CA 1.478 0.971 0 CA-C-O 117.896 -1.049 . . . . 0.0 111.217 177.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -76.49 44.56 1.41 Allowed 'Trans proline' 0 CA--C 1.55 1.279 1 C-N-CA 125.42 4.08 . . . . 0.0 114.008 -172.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -152.64 -61.17 0.15 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.319 1.448 . . . . 0.0 110.489 171.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.5 t -62.0 -36.83 82.71 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.142 0.977 . . . . 0.0 113.389 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 11.0 mmt -64.07 -24.54 67.74 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.105 0.962 . . . . 0.0 112.932 175.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.8 mt -93.08 -36.91 7.9 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 C-N-CA 124.994 1.317 . . . . 0.0 110.12 174.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -50.93 -43.05 60.05 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.425 1.49 . . . . 0.0 112.18 174.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 17.7 m -61.14 -34.21 74.64 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 170.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.27 -46.02 44.01 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.389 1.076 . . . . 0.0 112.385 174.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.275 1.0 OUTLIER -62.48 -36.11 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-O 117.677 -1.154 . . . . 0.0 109.396 175.487 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.11 -21.77 14.21 Favored 'General case' 0 CA--C 1.549 0.937 0 CA-C-N 121.24 1.837 . . . . 0.0 115.282 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.7 -43.34 18.62 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 119.856 1.207 . . . . 0.0 113.236 167.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.0 -39.03 61.42 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 120.758 -1.214 . . . . 0.0 112.836 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -63.92 -30.66 71.72 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.749 1.619 . . . . 0.0 110.837 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.14 -38.07 89.75 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 121.172 1.805 . . . . 0.0 111.574 166.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.8 t -61.8 -48.93 78.43 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 120.409 1.459 . . . . 0.0 113.017 171.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.52 -43.91 88.57 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 121.442 -0.787 . . . . 0.0 112.962 177.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 57.0 t90 -68.64 -52.91 26.18 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 125.518 1.527 . . . . 0.0 111.478 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 53.3 mt -58.26 -45.05 88.52 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 120.09 1.314 . . . . 0.0 110.054 179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.18 -57.56 10.69 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.118 0.967 . . . . 0.0 112.018 171.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -64.75 -33.66 76.5 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 43.2 m -67.15 -37.12 83.24 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.193 1.797 . . . . 0.0 111.849 174.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 136.3 13.77 0.99 Allowed Glycine 0 CA--C 1.539 1.556 0 N-CA-C 115.761 1.065 . . . . 0.0 115.761 174.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -135.07 55.9 14.97 Favored Pre-proline 0 CA--C 1.546 0.825 0 C-N-CA 126.598 1.959 . . . . 0.0 113.588 -170.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -58.46 -20.75 50.49 Favored 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.121 1.88 . . . . 0.0 113.824 178.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 58.8 tp60 -62.19 -39.21 91.96 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.681 1.592 . . . . 0.0 114.175 172.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -65.75 -36.09 82.57 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 120.482 -1.386 . . . . 0.0 112.943 -175.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.18 82.57 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 122.675 0.39 . . . . 0.0 112.04 171.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.08 -40.53 90.9 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.873 0.869 . . . . 0.0 112.424 173.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.5 mt -61.0 -34.75 75.3 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 175.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.457 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 80.0 t80 -74.27 -50.06 20.55 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.687 -0.633 . . . . 0.0 112.379 168.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -55.64 -29.21 58.87 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 119.716 1.144 . . . . 0.0 113.576 178.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -56.08 -56.15 24.33 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.414 1.486 . . . . 0.0 113.153 175.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.48 20.96 0.05 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.421 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 54.81 85.99 0.06 Allowed 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 127.363 2.265 . . . . 0.0 110.886 -169.607 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -78.76 120.22 80.11 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 125.323 1.449 . . . . 0.0 114.436 -176.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -93.43 71.02 0.41 Allowed 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 123.436 2.757 . . . . 0.0 112.281 -177.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.92 169.84 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 O-C-N 121.081 -1.012 . . . . 0.0 111.826 177.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -98.45 125.7 43.73 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.991 0.917 . . . . 0.0 109.807 170.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.0 mm -54.08 -34.52 26.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 123.915 0.886 . . . . 0.0 111.84 173.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -56.79 -49.21 76.0 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 119.37 0.987 . . . . 0.0 111.863 174.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.83 -45.3 93.22 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.286 0.635 . . . . 0.0 110.744 175.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -62.34 -39.64 84.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt -64.52 -40.87 96.42 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 125.649 1.58 . . . . 0.0 111.501 173.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 47.6 mtp180 -66.48 -28.15 68.35 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.401 1.08 . . . . 0.0 112.867 174.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -83.17 -41.87 17.96 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 171.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 7.3 m170 -103.48 48.71 0.84 Allowed 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.308 1.843 . . . . 0.0 110.855 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -81.42 -2.19 48.55 Favored 'General case' 0 CA--C 1.55 0.951 0 O-C-N 121.042 -1.036 . . . . 0.0 113.415 173.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -62.55 -17.87 60.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.569 1.548 . . . . 0.0 113.953 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.1 pp -111.43 165.68 11.77 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.262 2.225 . . . . 0.0 111.529 -178.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -63.53 148.47 48.66 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.022 0.529 . . . . 0.0 111.41 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 -53.25 -32.32 47.84 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.235 -0.916 . . . . 0.0 112.395 171.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -61.39 -39.97 92.65 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.817 0.847 . . . . 0.0 112.736 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -70.25 -35.28 73.69 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.284 170.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.84 -37.23 78.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 120.03 1.287 . . . . 0.0 112.012 171.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -68.15 -42.35 80.24 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 121.008 1.731 . . . . 0.0 111.881 176.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.68 -44.67 89.6 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.319 0.648 . . . . 0.0 111.792 176.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -50.08 71.33 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.559 1.543 . . . . 0.0 110.068 175.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 15.9 t -49.38 -36.57 22.22 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 125.417 1.487 . . . . 0.0 111.474 171.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -56.65 -43.83 80.71 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 121.445 1.93 . . . . 0.0 113.413 177.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -81.79 -42.58 19.52 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.608 0.763 . . . . 0.0 111.555 177.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -62.29 -49.33 76.07 Favored 'General case' 0 C--O 1.213 -0.835 0 CA-C-O 117.838 -1.077 . . . . 0.0 111.762 177.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -55.14 -45.36 75.63 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.929 1.695 . . . . 0.0 112.163 171.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.1 m -55.46 -41.33 72.75 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.065 1.302 . . . . 0.0 112.234 174.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.457 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.0 mp -75.39 -48.83 21.12 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.227 1.411 . . . . 0.0 112.434 177.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -60.8 -27.86 68.34 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 127.97 2.508 . . . . 0.0 112.65 175.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -70.93 -61.65 1.68 Allowed 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.962 1.705 . . . . 0.0 110.117 171.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 24.9 m -60.12 -12.72 9.13 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 172.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.4 -36.95 60.76 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 169.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 30.2 m -81.07 -14.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 CA-C-N 119.431 1.014 . . . . 0.0 113.115 172.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 17.3 ptm -136.25 47.38 2.22 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.827 1.651 . . . . 0.0 112.805 -178.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.0 pttp . . . . . 0 C--O 1.255 1.353 0 C-N-CA 126.532 1.933 . . . . 0.0 115.174 -179.707 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 120.327 0.108 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 50.7 t -137.73 -53.82 0.66 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.904 1.282 . . . . 0.0 111.419 -178.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.0 mtt180 -68.68 166.6 16.98 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.474 1.51 . . . . 0.0 111.648 165.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.5 mmmt 56.74 171.55 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 126.724 2.01 . . . . 0.0 114.181 -169.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -61.15 147.51 86.46 Favored Pre-proline 0 N--CA 1.48 1.06 0 C-N-CA 123.874 0.87 . . . . 0.0 110.923 175.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -68.45 128.08 16.69 Favored 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 122.402 2.068 . . . . 0.0 111.539 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 48.4 m-20 56.16 35.97 26.61 Favored 'General case' 0 CA--C 1.561 1.378 0 C-N-CA 127.355 2.262 . . . . 0.0 116.301 177.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.9 t -53.24 -37.73 62.35 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -177.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -33.05 72.99 Favored 'General case' 0 N--CA 1.481 1.123 0 O-C-N 120.991 -1.068 . . . . 0.0 112.332 178.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.2 mt -84.59 -35.32 10.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 117.413 -1.279 . . . . 0.0 110.093 175.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.74 -42.42 46.2 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 121.209 1.822 . . . . 0.0 112.734 174.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 m -58.38 -39.56 79.95 Favored 'General case' 0 N--CA 1.48 1.073 0 O-C-N 120.962 -1.086 . . . . 0.0 113.831 171.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -75.73 -38.31 58.61 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.504 1.047 . . . . 0.0 112.791 173.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.254 0.5 OUTLIER -61.96 -44.96 99.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 CA-C-N 120.155 1.343 . . . . 0.0 109.266 174.821 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 15.2 mm-40 -59.16 -28.25 66.41 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 119.807 1.185 . . . . 0.0 113.372 177.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -69.06 -48.31 63.1 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 120.152 1.342 . . . . 0.0 113.809 170.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttp -84.79 -29.79 25.13 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 121.147 -0.971 . . . . 0.0 113.612 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -24.94 63.24 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 126.324 1.849 . . . . 0.0 112.011 165.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.26 92.86 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 121.316 1.871 . . . . 0.0 110.868 164.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 33.1 t -58.42 -53.35 59.32 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 120.45 1.477 . . . . 0.0 112.376 171.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -59.63 -43.58 93.76 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -69.63 -51.65 33.07 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.208 1.403 . . . . 0.0 111.755 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.62 -44.1 93.57 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 119.204 0.911 . . . . 0.0 110.161 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -49.47 77.38 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 125.027 1.331 . . . . 0.0 113.16 173.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.08 72.87 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 113.658 0.985 . . . . 0.0 113.658 178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 15.8 m -71.11 -46.93 60.73 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.067 1.747 . . . . 0.0 111.603 178.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 147.58 13.19 0.15 Allowed Glycine 0 N--CA 1.475 1.281 0 N-CA-C 117.349 1.7 . . . . 0.0 117.349 178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -138.72 62.05 26.33 Favored Pre-proline 0 CA--C 1.55 0.968 0 CA-C-N 118.759 1.28 . . . . 0.0 114.209 -167.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -61.3 -21.59 72.19 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 121.75 1.634 . . . . 0.0 114.323 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.0 tp60 -63.88 -36.09 82.78 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.403 1.481 . . . . 0.0 114.179 174.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -68.84 -37.04 78.89 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.086 1.312 . . . . 0.0 112.182 -177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.6 -45.8 92.63 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.88 -0.513 . . . . 0.0 112.062 169.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 9.9 tp60 -60.07 -41.06 91.6 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.595 0.758 . . . . 0.0 112.412 176.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.15 -37.16 76.64 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.872 1.269 . . . . 0.0 113.74 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.488 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 75.8 t80 -74.24 -46.77 39.55 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.41 0.684 . . . . 0.0 112.707 171.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -62.16 -19.59 63.23 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 175.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -59.97 -58.64 7.68 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.819 1.648 . . . . 0.0 111.922 174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.16 25.56 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -177.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.41 91.68 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.617 2.367 . . . . 0.0 112.182 -170.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.58 117.75 69.34 Favored Pre-proline 0 CA--C 1.563 1.465 0 C-N-CA 124.947 1.299 . . . . 0.0 113.867 -176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -93.04 67.11 0.53 Allowed 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 124.113 3.208 . . . . 0.0 113.005 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -72.99 167.7 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 O-C-N 120.893 -1.129 . . . . 0.0 110.818 177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -93.89 126.79 39.29 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.364 1.066 . . . . 0.0 109.753 169.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.2 mm -54.42 -36.94 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.207 170.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.33 -19.24 63.12 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 115.31 1.596 . . . . 0.0 115.31 174.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.98 -45.33 13.24 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.229 1.011 . . . . 0.0 110.202 166.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -62.44 -41.9 93.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.45 -19.88 65.91 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 124.885 1.274 . . . . 0.0 114.262 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 58.8 mtp180 -84.34 -42.11 16.09 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.261 1.025 . . . . 0.0 112.459 169.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -72.24 -28.34 63.09 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 119.11 0.868 . . . . 0.0 113.055 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.2 m170 -114.68 36.59 3.75 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 127.386 2.274 . . . . 0.0 111.185 176.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -57.39 -14.79 5.2 Favored 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 172.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -54.21 -39.06 66.34 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 126.719 2.008 . . . . 0.0 112.761 167.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 47.2 mt -78.66 143.59 36.18 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.845 1.258 . . . . 0.0 110.46 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -62.49 160.27 14.01 Favored 'General case' 0 N--CA 1.478 0.949 0 O-C-N 121.347 -0.845 . . . . 0.0 112.624 171.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 53.5 mtp180 -57.67 -33.12 68.01 Favored 'General case' 0 N--CA 1.477 0.92 0 O-C-N 121.566 -0.709 . . . . 0.0 112.572 173.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -66.72 -43.82 83.23 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.685 0.794 . . . . 0.0 111.871 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.37 -43.87 96.41 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.536 0.734 . . . . 0.0 111.063 170.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -35.67 72.64 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 CA-C-O 117.384 -1.293 . . . . 0.0 112.738 175.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -66.83 -44.57 80.77 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 121.347 1.885 . . . . 0.0 112.091 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.42 -45.63 92.21 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.083 0.553 . . . . 0.0 111.994 177.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.65 -49.28 71.65 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.428 1.491 . . . . 0.0 110.249 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 30.7 t -51.56 -33.85 34.24 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 125.247 1.419 . . . . 0.0 112.214 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 ttt85 -57.8 -38.65 75.89 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 120.993 1.724 . . . . 0.0 113.671 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -87.38 -40.94 13.97 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.419 1.088 . . . . 0.0 112.056 175.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.58 -46.35 79.73 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.335 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -60.49 -35.19 75.32 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.773 1.624 . . . . 0.0 112.488 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 15' ' ' GLU . 2.4 m -57.72 -50.3 73.68 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 120.173 1.351 . . . . 0.0 111.547 166.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.488 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 0.5 OUTLIER -67.53 -37.77 83.23 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 121.361 -0.837 . . . . 0.0 112.961 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -73.81 -41.09 62.85 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.477 1.911 . . . . 0.0 111.309 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -66.66 -47.97 70.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 118.076 -0.964 . . . . 0.0 110.174 172.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.9 m -63.86 -13.03 41.54 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 120.138 1.336 . . . . 0.0 114.0 173.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.13 -16.09 32.29 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 171.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -113.23 -26.84 2.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.325 1.45 . . . . 0.0 111.929 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.0 mmt -90.65 23.77 2.93 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 128.147 2.579 . . . . 0.0 112.828 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.9 mttt . . . . . 0 C--O 1.255 1.346 0 C-N-CA 126.998 2.119 . . . . 0.0 111.583 -179.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.1 ptp . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 119.732 -0.175 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.5 t 47.0 74.13 0.16 Allowed 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 126.774 2.03 . . . . 0.0 114.329 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -46.76 0.7 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -173.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -134.82 26.01 3.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 125.847 1.659 . . . . 0.0 113.21 -176.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -55.02 150.31 20.32 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.141 1.376 . . . . 0.0 112.809 -178.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.35 -17.92 30.35 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.345 2.697 . . . . 0.0 113.374 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -145.77 107.58 4.3 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.511 1.924 . . . . 0.0 108.489 173.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.6 t -122.03 -32.91 3.63 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.755 1.222 . . . . 0.0 112.697 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 14.2 mmt -58.36 -31.4 67.58 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.316 1.046 . . . . 0.0 112.656 170.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.1 mt -94.42 -27.95 4.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.226 175.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.9 tp -53.69 -40.07 65.69 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 121.107 1.776 . . . . 0.0 112.476 175.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 m -59.5 -38.14 80.12 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.97 0.908 . . . . 0.0 112.887 172.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -76.48 -38.39 55.4 Favored 'General case' 0 N--CA 1.469 0.499 0 O-C-N 121.318 -0.864 . . . . 0.0 112.882 174.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.251 0.5 OUTLIER -65.06 -37.41 80.15 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.953 0 CA-C-N 119.828 1.195 . . . . 0.0 109.79 172.463 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -60.33 -28.34 68.07 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 120.357 1.435 . . . . 0.0 113.477 176.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.5 -53.46 23.09 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 119.328 0.967 . . . . 0.0 112.135 169.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 pttt -73.69 -32.16 63.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -178.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -71.52 -36.45 71.04 Favored 'General case' 0 C--O 1.218 -0.575 0 C-N-CA 126.161 1.784 . . . . 0.0 110.242 173.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.64 95.96 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 120.69 1.587 . . . . 0.0 110.106 166.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.2 t -56.27 -52.7 63.54 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 120.689 1.586 . . . . 0.0 113.482 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -67.29 -40.56 86.1 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.311 1.044 . . . . 0.0 112.877 -178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 41.1 t90 -66.79 -52.66 41.37 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.536 1.534 . . . . 0.0 111.129 174.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.5 mt -59.49 -46.38 88.96 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.637 1.108 . . . . 0.0 110.104 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.0 ttm180 -56.26 -54.66 42.74 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 124.573 1.149 . . . . 0.0 111.916 172.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.54 -29.44 69.53 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.635 0.976 . . . . 0.0 113.635 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.2 m -73.73 -49.55 25.04 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.829 1.651 . . . . 0.0 111.752 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.29 15.57 0.07 OUTLIER Glycine 0 CA--C 1.538 1.524 0 N-CA-C 117.274 1.67 . . . . 0.0 117.274 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -141.44 59.57 10.42 Favored Pre-proline 0 CA--C 1.548 0.87 0 C-N-CA 125.817 1.647 . . . . 0.0 114.126 -167.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -60.92 -17.5 51.53 Favored 'Trans proline' 0 CA--C 1.55 1.307 0 C-N-CA 122.034 1.823 . . . . 0.0 113.874 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 33.0 tp60 -69.59 -38.49 77.35 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.454 1.502 . . . . 0.0 114.267 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.442 ' HB3' HD21 ' A' ' 66' ' ' LEU . 13.9 m-85 -64.21 -34.97 79.31 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-N 120.623 1.556 . . . . 0.0 112.009 -179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.16 -47.14 78.07 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.478 0.711 . . . . 0.0 112.147 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -58.14 -38.96 77.55 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.548 0.739 . . . . 0.0 112.822 175.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mt -60.77 -39.05 87.34 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.086 0.955 . . . . 0.0 113.044 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.459 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 76.1 t80 -75.73 -46.18 32.46 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 121.482 -0.761 . . . . 0.0 112.393 172.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -61.5 -17.11 53.19 Favored 'General case' 0 CA--C 1.546 0.815 0 O-C-N 121.437 -0.789 . . . . 0.0 112.977 176.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -63.73 -55.35 23.9 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.242 1.417 . . . . 0.0 113.008 171.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -169.15 23.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 115.622 1.712 . . . . 0.0 115.622 -177.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.459 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 54.64 89.04 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.433 2.293 . . . . 0.0 111.627 -171.505 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.97 118.43 70.91 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 125.531 1.533 . . . . 0.0 114.3 -175.135 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -92.69 72.47 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.885 2.39 . . . . 0.0 112.464 -176.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -77.01 168.48 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 CA-C-O 121.718 0.77 . . . . 0.0 111.547 176.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -99.35 124.76 44.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.493 0.717 . . . . 0.0 109.712 170.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.0 mm -57.51 -31.54 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 O-C-N 121.467 -0.771 . . . . 0.0 111.642 174.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.5 t -54.23 -40.06 67.33 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 119.423 1.01 . . . . 0.0 112.414 171.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.93 -40.3 60.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.416 1.486 . . . . 0.0 112.395 173.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.3 -36.12 60.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 O-C-N 121.506 -0.746 . . . . 0.0 112.156 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -60.94 -37.26 81.72 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 126.739 2.016 . . . . 0.0 112.336 173.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -65.02 -31.77 73.17 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.088 0.955 . . . . 0.0 113.209 174.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -81.02 -16.03 54.49 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 168.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.408 ' CD2' HG12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -85.59 -5.17 59.3 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.88 1.272 . . . . 0.0 113.677 177.287 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -47.0 -22.76 0.37 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 -170.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -54.66 -37.06 65.27 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.24 2.216 . . . . 0.0 114.393 168.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 9.2 mt -91.59 -170.14 2.51 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 128.933 2.893 . . . . 0.0 110.031 -178.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -107.11 151.36 25.48 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 120.44 -1.413 . . . . 0.0 111.782 173.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.16 -29.23 1.47 Allowed 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 115.018 1.488 . . . . 0.0 115.018 173.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -70.99 -33.96 70.93 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.518 1.127 . . . . 0.0 112.644 175.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.18 -36.68 77.58 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.394 1.077 . . . . 0.0 111.539 167.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.408 HG12 ' CD2' ' A' ' 51' ' ' HIS . 0.3 OUTLIER -62.24 -43.43 97.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 CA-C-N 120.356 1.434 . . . . 0.0 111.553 168.156 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -60.6 -28.04 68.19 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 121.787 2.085 . . . . 0.0 112.441 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.11 -49.68 12.23 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 124.757 1.223 . . . . 0.0 113.011 171.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 31.2 tp -62.22 -45.93 91.15 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.92 1.288 . . . . 0.0 112.053 177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 46.3 t -54.05 -28.11 36.65 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 127.511 2.324 . . . . 0.0 111.943 168.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -50.55 72.89 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 122.544 2.429 . . . . 0.0 111.305 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.5 mmt180 -73.5 -51.95 15.29 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.385 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 31' ' ' TYR . 22.0 mt -59.3 -43.12 92.65 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 117.099 -1.429 . . . . 0.0 113.021 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -56.1 -52.28 64.87 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.192 2.269 . . . . 0.0 110.675 171.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 5.9 m -51.4 -45.27 62.46 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.55 1.068 . . . . 0.0 112.66 174.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 mt -69.19 -47.96 63.44 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.21 1.004 . . . . 0.0 112.88 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -63.7 -30.66 71.73 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.737 2.015 . . . . 0.0 112.534 177.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -74.23 -54.12 8.38 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 126.572 1.949 . . . . 0.0 109.976 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 93.4 m -60.77 -14.25 20.28 Favored 'General case' 0 CA--C 1.552 1.047 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -83.28 -23.35 32.69 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 119.871 -1.768 . . . . 0.0 115.293 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 29.6 m -96.21 -24.38 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-N 119.538 1.063 . . . . 0.0 113.309 170.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 6.5 ptm -118.84 15.74 13.47 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -173.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.2 mttt . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 128.395 2.678 . . . . 0.0 114.913 -173.383 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 121.099 0.476 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 25.3 p -140.5 41.48 1.89 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.566 1.546 . . . . 0.0 111.397 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.9 ptm180 -48.81 157.32 0.4 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.882 1.273 . . . . 0.0 112.164 172.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.18 118.4 2.12 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.311 0.644 . . . . 0.0 110.325 176.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -75.61 138.37 70.51 Favored Pre-proline 0 CA--C 1.543 0.679 0 CA-C-O 118.158 -0.925 . . . . 0.0 108.631 -175.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -68.17 -177.65 1.45 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.435 2.09 . . . . 0.0 111.416 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -68.3 33.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 126.156 1.783 . . . . 0.0 114.856 -176.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.3 t -73.48 -35.47 65.69 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 126.942 2.097 . . . . 0.0 113.731 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 17.8 mmt -58.46 -34.25 70.64 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.168 0.987 . . . . 0.0 111.892 174.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 18.0 mt -85.78 -41.92 15.68 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 CA-C-O 117.334 -1.317 . . . . 0.0 110.671 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.44 -39.36 57.23 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 120.99 1.723 . . . . 0.0 112.146 176.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 m -62.2 -39.48 92.9 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.179 0.992 . . . . 0.0 113.651 171.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.4 mt-30 -74.69 -34.23 62.59 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.119 -0.988 . . . . 0.0 113.169 173.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -66.76 -36.94 78.44 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.682 0 CA-C-N 120.442 1.474 . . . . 0.0 109.591 172.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 74.5 mt-10 -59.25 -13.89 9.27 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.708 1.14 . . . . 0.0 113.902 173.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -81.07 -46.82 14.41 Favored 'General case' 0 CA--C 1.546 0.802 0 CA-C-N 120.074 1.306 . . . . 0.0 113.206 165.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -83.35 -39.68 20.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -176.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -71.73 -19.54 62.03 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 126.267 1.827 . . . . 0.0 111.836 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.661 ' HB1' HD21 ' A' ' 69' ' ' LEU . . . -65.14 -52.4 55.42 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-N 119.387 0.994 . . . . 0.0 110.331 159.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.9 t -56.72 -47.25 80.39 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.99 1.268 . . . . 0.0 112.367 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -60.09 -47.36 86.22 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.82 0.848 . . . . 0.0 112.163 176.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 33.6 t90 -68.47 -52.23 34.73 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 123.408 0.683 . . . . 0.0 112.585 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.15 -44.33 79.16 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 119.567 1.076 . . . . 0.0 110.516 178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 40.4 ttp180 -63.21 -48.68 77.26 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.343 1.057 . . . . 0.0 112.673 175.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -67.51 -30.3 69.94 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.971 0.908 . . . . 0.0 113.437 179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 16.4 m -73.4 -53.25 11.17 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.899 1.68 . . . . 0.0 111.677 176.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 151.24 19.08 0.06 OUTLIER Glycine 0 CA--C 1.535 1.335 0 N-CA-C 117.428 1.731 . . . . 0.0 117.428 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -142.22 65.97 19.3 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 119.371 1.585 . . . . 0.0 113.433 -168.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -62.11 -15.07 41.56 Favored 'Trans proline' 0 CA--C 1.548 1.216 0 C-N-CA 122.574 2.182 . . . . 0.0 113.588 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.4 tp60 -70.93 -41.44 71.18 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.391 1.476 . . . . 0.0 114.585 173.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -64.77 -37.28 87.06 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.627 -1.296 . . . . 0.0 112.258 -177.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.82 92.62 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.983 0.513 . . . . 0.0 111.524 169.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -63.95 -35.7 81.53 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.5 mt -61.57 -37.34 83.5 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.384 1.074 . . . . 0.0 112.908 173.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.467 ' CZ ' HD12 ' A' ' 39' ' ' LEU . 81.0 t80 -79.97 -46.91 15.84 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.285 -0.884 . . . . 0.0 112.555 172.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -63.11 -17.15 62.01 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 120.892 -1.13 . . . . 0.0 113.383 176.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -62.4 -58.61 7.01 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.653 1.181 . . . . 0.0 112.41 167.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -165.49 26.92 0.05 Allowed 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.645 1.35 . . . . 0.0 114.645 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.467 HD12 ' CZ ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 51.86 83.93 0.05 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.478 1.911 . . . . 0.0 111.635 -173.433 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.407 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -78.59 119.2 76.39 Favored Pre-proline 0 CA--C 1.559 1.317 0 C-N-CA 125.224 1.41 . . . . 0.0 114.326 -177.373 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -91.55 75.14 0.64 Allowed 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 123.134 2.556 . . . . 0.0 112.62 -179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -81.7 166.47 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 121.295 -0.878 . . . . 0.0 111.042 177.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -95.28 129.59 42.36 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.574 0.75 . . . . 0.0 109.553 170.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.1 mm -55.8 -38.18 50.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.597 0 O-C-N 121.417 -0.802 . . . . 0.0 110.86 171.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 m -58.21 -28.57 64.95 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.369 0.877 . . . . 0.0 113.369 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 tt -71.04 -60.16 2.38 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 119.767 1.167 . . . . 0.0 110.653 174.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.4 HG21 HD23 ' A' ' 66' ' ' LEU . 11.2 m -63.43 -32.63 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.2 ttmt -61.85 -48.51 80.22 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.951 1.3 . . . . 0.0 111.437 172.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -62.6 -39.3 93.33 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.135 0.974 . . . . 0.0 112.216 175.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.28 -36.42 74.38 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.38 -75.51 0.13 Allowed 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.11 0.868 . . . . 0.0 110.887 171.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 29.8 t70 39.62 36.25 0.23 Allowed 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 126.405 1.882 . . . . 0.0 113.835 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -134.04 -47.66 0.79 Allowed 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.587 1.555 . . . . 0.0 111.862 -165.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.5 mt -69.58 170.81 9.96 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.74 1.216 . . . . 0.0 110.654 170.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -63.36 157.73 22.29 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 121.194 -0.941 . . . . 0.0 112.794 172.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.61 -36.94 62.52 Favored 'General case' 0 N--CA 1.479 0.984 0 O-C-N 121.282 -0.887 . . . . 0.0 112.688 167.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.84 -34.79 76.07 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 124.401 1.081 . . . . 0.0 112.123 176.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.09 -42.71 84.16 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.595 -0.717 . . . . 0.0 110.948 173.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -63.71 -40.93 90.87 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 CA-C-O 117.282 -1.342 . . . . 0.0 111.689 172.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -66.54 -39.31 88.52 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 121.276 1.853 . . . . 0.0 112.804 176.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.01 76.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.352 1.061 . . . . 0.0 112.048 175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -48.81 69.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.7 0.8 . . . . 0.0 109.841 175.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 20.1 t -50.73 -37.3 40.89 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 125.611 1.565 . . . . 0.0 112.0 171.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.0 ttt-85 -52.41 -50.63 62.13 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 121.304 1.865 . . . . 0.0 112.378 175.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.408 ' O ' HD22 ' A' ' 69' ' ' LEU . 52.3 mmt-85 -75.59 -51.28 13.23 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.419 -0.801 . . . . 0.0 112.159 174.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.4 HD23 HG21 ' A' ' 47' ' ' VAL . 1.5 tp -56.52 -43.06 79.41 Favored 'General case' 0 C--O 1.215 -0.75 0 CA-C-N 119.871 1.214 . . . . 0.0 112.192 -178.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -53.88 -47.89 70.63 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 120.516 1.507 . . . . 0.0 111.685 167.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -54.64 -42.67 71.53 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.493 1.042 . . . . 0.0 112.39 174.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.661 HD21 ' HB1' ' A' ' 19' ' ' ALA . 0.3 OUTLIER -69.67 -52.0 29.59 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.431 0.692 . . . . 0.0 112.647 174.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -60.05 -32.37 70.85 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.475 1.91 . . . . 0.0 112.178 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.5 ttmt -74.76 -53.9 8.35 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 126.475 1.91 . . . . 0.0 110.582 174.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 69.0 m -64.59 -0.97 1.57 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 120.171 1.351 . . . . 0.0 114.196 170.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.51 -25.68 14.68 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 126.698 1.999 . . . . 0.0 114.053 172.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 27.8 m -92.81 -32.5 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 CA-C-N 119.022 0.828 . . . . 0.0 111.818 166.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 mtp -88.48 50.18 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.077 2.151 . . . . 0.0 111.149 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 28.0 tttp . . . . . 0 C--O 1.256 1.405 0 C-N-CA 128.003 2.521 . . . . 0.0 114.603 171.27 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 32.0 p -57.06 166.28 1.09 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.675 0.79 . . . . 0.0 112.549 166.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.1 mmm180 58.49 -70.33 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 127.407 2.283 . . . . 0.0 113.926 -171.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.57 63.86 4.12 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.077 2.151 . . . . 0.0 110.521 175.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -59.89 146.43 81.86 Favored Pre-proline 0 N--CA 1.474 0.735 0 C-N-CA 123.778 0.831 . . . . 0.0 111.556 172.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.73 -14.55 30.06 Favored 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 123.273 2.649 . . . . 0.0 112.412 176.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -125.57 125.86 43.86 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.281 1.432 . . . . 0.0 110.184 175.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.4 t -131.37 -42.39 1.06 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.464 1.506 . . . . 0.0 111.103 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -56.42 -49.39 74.68 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.04 1.336 . . . . 0.0 111.541 171.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -80.06 -32.95 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 CA-C-O 116.992 -1.48 . . . . 0.0 110.896 177.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -51.94 -41.31 61.95 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 121.141 1.792 . . . . 0.0 111.658 174.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -60.6 -38.51 84.88 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.044 1.127 . . . . 0.0 114.044 170.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -73.08 -42.68 62.75 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.804 -1.185 . . . . 0.0 113.696 174.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.296 0.8 OUTLIER -59.66 -43.05 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-O 116.793 -1.575 . . . . 0.0 109.273 170.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -56.76 -17.56 9.49 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 121.74 2.064 . . . . 0.0 114.858 173.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -90.54 -43.85 9.95 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 119.481 1.037 . . . . 0.0 112.977 168.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.66 -43.35 89.65 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 119.501 1.046 . . . . 0.0 111.854 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -30.93 64.3 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 125.094 1.358 . . . . 0.0 110.687 177.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.98 -38.54 86.24 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 120.22 1.373 . . . . 0.0 111.008 165.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.8 t -61.24 -51.8 67.43 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.821 1.646 . . . . 0.0 112.3 173.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -63.24 -45.03 93.46 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.627 0.771 . . . . 0.0 112.339 177.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.2 t90 -64.53 -56.37 14.5 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.843 1.257 . . . . 0.0 111.229 177.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 50.2 mt -57.09 -44.15 82.88 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 120.196 1.362 . . . . 0.0 110.511 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -58.56 -53.22 60.81 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.159 0.983 . . . . 0.0 113.077 172.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.65 -29.89 68.46 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 19.3 m -69.96 -38.95 76.25 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.938 2.095 . . . . 0.0 111.473 175.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.64 11.52 1.47 Allowed Glycine 0 CA--C 1.537 1.452 0 N-CA-C 115.847 1.099 . . . . 0.0 115.847 175.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.33 55.94 20.43 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 126.5 1.92 . . . . 0.0 113.058 -173.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -58.98 -16.71 33.81 Favored 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.562 2.175 . . . . 0.0 114.046 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 52.3 tp60 -66.37 -40.64 89.85 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.791 1.636 . . . . 0.0 114.433 172.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -63.91 -36.34 83.63 Favored 'General case' 0 N--CA 1.475 0.799 0 O-C-N 120.232 -1.543 . . . . 0.0 112.75 -177.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.51 -40.46 94.7 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 122.825 0.45 . . . . 0.0 111.714 171.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -65.86 -38.84 89.89 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.41 HD22 ' CD2' ' A' ' 40' ' ' PHE . 1.9 mt -60.51 -35.44 75.96 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 119.193 0.906 . . . . 0.0 112.453 174.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CE2' HD12 ' A' ' 39' ' ' LEU . 71.9 t80 -76.62 -48.61 18.59 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 121.578 -0.702 . . . . 0.0 112.829 170.449 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -61.54 -17.98 57.21 Favored 'General case' 0 CA--C 1.548 0.874 0 O-C-N 120.737 -1.227 . . . . 0.0 113.196 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -62.59 -54.83 33.83 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.359 1.463 . . . . 0.0 112.797 170.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.31 20.62 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.455 HD12 ' CE2' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 55.1 88.99 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 127.221 2.208 . . . . 0.0 110.58 -170.059 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.41 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -83.75 118.19 70.72 Favored Pre-proline 0 CA--C 1.557 1.237 0 C-N-CA 125.264 1.425 . . . . 0.0 114.039 -177.214 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -90.62 79.86 0.55 Allowed 'Trans proline' 0 C--N 1.351 0.705 0 C-N-CA 122.975 2.45 . . . . 0.0 111.726 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -85.91 168.61 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-O 121.555 0.693 . . . . 0.0 111.087 176.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 42.5 t0 -98.8 129.05 45.19 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.515 0.726 . . . . 0.0 109.283 170.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.3 mm -59.58 -30.39 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 121.012 -1.055 . . . . 0.0 111.769 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.2 t -59.67 -31.91 69.98 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 119.274 0.943 . . . . 0.0 112.561 171.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.7 tt -81.94 -38.3 25.44 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 125.083 1.353 . . . . 0.0 112.056 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.88 -37.52 68.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 O-C-N 120.865 -1.147 . . . . 0.0 112.72 -177.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -48.27 82.53 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.909 1.283 . . . . 0.0 111.715 176.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -64.92 -34.68 78.98 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 176.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -72.86 -35.3 67.17 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 30.4 m80 -119.86 62.47 0.83 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.485 1.914 . . . . 0.0 110.067 -179.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -92.02 10.55 28.59 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.858 1.663 . . . . 0.0 112.02 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -64.03 -18.71 64.6 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.849 1.66 . . . . 0.0 113.721 176.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.7 165.47 17.88 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 127.67 2.388 . . . . 0.0 111.058 -177.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 86.9 m-20 -63.02 160.85 14.19 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.629 0.772 . . . . 0.0 112.226 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 52.8 mtm-85 -56.26 -31.88 63.99 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 121.145 -0.972 . . . . 0.0 112.721 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -63.28 -39.05 93.49 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.96 0.904 . . . . 0.0 112.33 174.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.55 -38.59 84.38 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 118.422 -0.799 . . . . 0.0 111.188 172.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -64.39 -39.09 84.33 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-O 117.801 -1.095 . . . . 0.0 112.371 170.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -66.12 -36.52 83.38 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 121.177 1.808 . . . . 0.0 111.361 178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -71.14 -47.65 56.59 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.58 1.152 . . . . 0.0 112.37 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 32.1 tp -63.72 -42.8 97.88 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 125.178 1.391 . . . . 0.0 111.533 176.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 29.6 t -52.4 -32.59 39.67 Favored 'General case' 0 C--O 1.215 -0.724 0 C-N-CA 125.851 1.661 . . . . 0.0 110.97 168.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -61.17 -47.52 85.8 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 121.682 2.037 . . . . 0.0 112.637 176.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -73.62 -52.14 14.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 118.598 -0.715 . . . . 0.0 111.61 175.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 66' ' ' LEU . 21.6 mt -58.73 -44.12 90.36 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 116.733 -1.603 . . . . 0.0 112.535 178.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -53.63 -51.35 63.38 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 122.397 2.362 . . . . 0.0 110.639 170.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 2.0 m -53.48 -46.16 69.88 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 119.43 1.014 . . . . 0.0 112.546 174.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 31.6 mt -69.23 -47.99 63.19 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.464 1.105 . . . . 0.0 112.412 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 59.0 m-20 -62.75 -33.99 76.28 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.705 2.402 . . . . 0.0 112.474 176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ttmm -69.95 -55.12 10.46 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 126.08 1.752 . . . . 0.0 110.055 173.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 90.0 m -64.99 3.34 0.58 Allowed 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 168.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -103.3 -24.54 13.51 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.805 1.642 . . . . 0.0 113.875 170.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.0 m -88.35 -35.07 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 CA-C-N 119.237 0.926 . . . . 0.0 112.358 168.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.2 ptm -86.06 19.14 2.73 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.6 mtpm? . . . . . 0 C--O 1.25 1.131 0 C-N-CA 125.799 1.64 . . . . 0.0 112.3 179.221 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 tpp . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 119.669 -0.205 . . . . 0.0 110.666 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t 59.48 179.44 0.08 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 125.485 1.514 . . . . 0.0 112.828 -168.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 42.77 94.92 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.103 2.561 . . . . 0.0 115.744 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mttt 67.06 108.13 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 127.575 2.35 . . . . 0.0 111.55 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 44.7 mttp -59.52 149.04 72.15 Favored Pre-proline 0 N--CA 1.472 0.652 0 C-N-CA 124.019 0.928 . . . . 0.0 111.614 179.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -74.99 71.04 5.13 Favored 'Trans proline' 0 CA--C 1.545 1.038 0 C-N-CA 123.962 3.108 . . . . 0.0 111.892 -177.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 59.51 103.79 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 128.697 2.799 . . . . 0.0 113.565 -176.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.2 t -52.77 -34.84 54.95 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.499 -1.376 . . . . 0.0 114.106 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 1.2 mtp -62.74 -28.19 69.79 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.41 1.484 . . . . 0.0 113.116 174.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mt -94.54 -33.04 4.81 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.373 173.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -51.38 -41.47 60.71 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 121.176 1.807 . . . . 0.0 111.763 178.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.76 -37.0 80.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 171.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -75.29 -41.39 57.19 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.079 -1.013 . . . . 0.0 113.458 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.1 tt -62.25 -41.66 92.32 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.71 0 CA-C-N 120.323 1.419 . . . . 0.0 109.557 170.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.91 -22.09 13.75 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 121.118 1.781 . . . . 0.0 114.557 173.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.13 -46.97 26.14 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.756 1.162 . . . . 0.0 113.257 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.1 ptmm? -77.54 -38.28 49.0 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -71.68 -19.47 62.07 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 126.084 1.754 . . . . 0.0 111.392 173.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' CB ' HD21 ' A' ' 69' ' ' LEU . . . -70.61 -40.74 72.99 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 120.809 1.641 . . . . 0.0 111.223 162.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 21.9 t -60.25 -52.17 66.45 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 120.169 1.349 . . . . 0.0 111.952 171.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -61.57 -42.62 99.11 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.14 0.576 . . . . 0.0 112.329 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 45.0 t90 -68.13 -52.67 32.2 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.264 176.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 56.9 mt -60.06 -43.76 95.18 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 119.762 1.164 . . . . 0.0 110.479 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 ttt85 -56.86 -54.15 49.72 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.615 1.166 . . . . 0.0 112.46 171.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -65.33 -32.91 74.79 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 m -69.76 -47.7 61.99 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.72 1.608 . . . . 0.0 111.516 175.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.3 19.65 0.09 OUTLIER Glycine 0 N--CA 1.475 1.291 0 N-CA-C 117.016 1.566 . . . . 0.0 117.016 175.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -142.44 64.57 16.4 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 125.181 1.393 . . . . 0.0 113.334 -166.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -63.55 -15.15 46.82 Favored 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 122.282 1.988 . . . . 0.0 113.378 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -70.96 -41.98 70.36 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.093 1.357 . . . . 0.0 114.352 174.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -63.37 -38.21 90.28 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 120.186 1.357 . . . . 0.0 112.496 -177.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.61 -34.31 75.43 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.398 0.679 . . . . 0.0 112.173 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 -75.57 -37.19 60.12 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.363 1.065 . . . . 0.0 112.855 177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -59.7 -36.52 76.69 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.372 1.069 . . . . 0.0 111.807 171.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.651 ' CG ' HD22 ' A' ' 69' ' ' LEU . 74.9 t80 -74.71 -51.47 14.19 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 169.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -57.32 -26.87 61.6 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.428 -1.42 . . . . 0.0 113.555 178.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -56.75 -54.68 43.42 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.211 1.404 . . . . 0.0 112.954 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -164.99 15.96 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 114.916 1.451 . . . . 0.0 114.916 -177.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.49 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 1.9 mt 58.58 93.53 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.809 2.044 . . . . 0.0 110.661 -168.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 0.1 OUTLIER -87.95 117.44 68.46 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 125.115 1.366 . . . . 0.0 113.823 -178.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -91.32 78.25 0.51 Allowed 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.16 2.573 . . . . 0.0 112.176 178.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -82.17 169.78 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 121.256 -0.902 . . . . 0.0 111.366 176.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -97.67 124.44 41.99 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.556 0.742 . . . . 0.0 110.229 171.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 34.2 mm -55.02 -30.62 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.175 170.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.55 -28.15 66.86 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 119.899 1.227 . . . . 0.0 113.565 173.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.62 -45.48 13.43 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.057 0.943 . . . . 0.0 111.386 171.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.2 t -65.5 -33.73 65.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.7 ttmt -62.89 -29.94 71.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.685 1.594 . . . . 0.0 111.686 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -66.82 -33.31 75.33 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 120.971 -1.081 . . . . 0.0 111.98 171.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -76.69 12.86 1.15 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.995 1.718 . . . . 0.0 114.03 165.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.37 6.37 11.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.907 1.683 . . . . 0.0 112.607 172.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -28.31 1.77 Allowed 'General case' 0 CA--C 1.553 1.095 0 O-C-N 120.405 -1.434 . . . . 0.0 114.724 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.8 p90 -94.19 -17.94 22.22 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 126.412 1.885 . . . . 0.0 115.096 175.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 77.1 mt -82.54 -179.02 7.29 Favored 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.537 1.935 . . . . 0.0 111.985 172.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -97.24 156.49 16.4 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.438 1.495 . . . . 0.0 112.487 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -53.8 -41.37 67.22 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 121.26 -0.9 . . . . 0.0 112.241 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -63.56 -37.11 86.05 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.637 0.775 . . . . 0.0 112.956 172.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.96 95.54 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.957 0.799 . . . . 0.0 111.431 173.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.78 -45.68 83.92 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-O 116.799 -1.572 . . . . 0.0 112.095 169.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -61.21 -33.48 73.55 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 122.228 2.286 . . . . 0.0 112.278 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.43 -52.24 28.67 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.559 1.544 . . . . 0.0 112.262 172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.08 -49.96 68.0 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.039 0.936 . . . . 0.0 110.555 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 41.9 t -50.04 -30.16 10.22 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 126.313 1.845 . . . . 0.0 112.4 168.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 22.5 ttp85 -59.97 -46.65 88.75 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 122.328 2.331 . . . . 0.0 112.184 174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 58.5 mmt-85 -76.75 -48.55 18.38 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 118.67 -0.681 . . . . 0.0 112.413 173.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 mp -60.33 -41.78 94.26 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 117.31 -1.329 . . . . 0.0 112.377 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 -53.43 -51.93 61.07 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.763 2.074 . . . . 0.0 110.417 170.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 3.6 m -53.08 -48.36 67.81 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.029 0.831 . . . . 0.0 112.14 174.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.651 HD22 ' CG ' ' A' ' 35' ' ' TYR . 96.5 mt -69.0 -48.46 63.04 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.887 0.875 . . . . 0.0 112.711 -179.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -62.54 -37.51 86.4 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.555 1.942 . . . . 0.0 111.926 177.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.7 tmmt? -67.21 -56.61 9.15 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 125.148 1.379 . . . . 0.0 109.929 172.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.7 m -58.16 -20.61 42.15 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 119.443 1.02 . . . . 0.0 113.61 175.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.93 -25.04 37.75 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.487 1.915 . . . . 0.0 115.425 171.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -96.18 -36.07 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 124.579 1.152 . . . . 0.0 111.576 176.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.7 ptm -85.03 3.65 37.63 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.238 1.415 . . . . 0.0 113.747 175.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.192 0 C-N-CA 126.151 1.781 . . . . 0.0 114.596 -177.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 72.2 m 54.52 117.14 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 127.59 2.356 . . . . 0.0 115.45 -171.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.5 mtt180 -101.81 156.13 17.7 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.706 1.602 . . . . 0.0 112.042 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 76.7 mttt 39.35 61.94 1.24 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.168 1.787 . . . . 0.0 112.984 -171.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt -53.83 141.63 46.71 Favored Pre-proline 0 N--CA 1.476 0.852 0 C-N-CA 124.469 1.108 . . . . 0.0 111.457 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -67.5 114.61 3.34 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.608 2.205 . . . . 0.0 109.787 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 51.65 54.96 10.09 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.554 1.542 . . . . 0.0 114.701 -178.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.2 t -53.49 -34.9 59.77 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.522 -1.361 . . . . 0.0 114.613 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 15.9 tpt -59.98 -39.63 86.36 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.209 -0.932 . . . . 0.0 111.954 174.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.7 mt -79.35 -34.68 16.39 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-O 117.144 -1.408 . . . . 0.0 110.571 175.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.8 tp -50.09 -39.28 42.04 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 120.965 1.711 . . . . 0.0 112.077 175.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -61.97 -40.89 97.16 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 114.213 1.19 . . . . 0.0 114.213 170.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -71.6 -42.3 67.89 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 120.862 -1.149 . . . . 0.0 113.554 174.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.267 1.3 tt -64.23 -36.25 76.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 CA-C-O 117.302 -1.332 . . . . 0.0 110.12 170.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -61.42 -29.7 70.1 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 122.21 2.277 . . . . 0.0 113.294 172.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.4 -58.28 6.91 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 119.325 0.966 . . . . 0.0 111.182 167.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -63.31 -36.67 84.47 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -177.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.84 -42.46 90.49 Favored 'General case' 0 CA--C 1.508 -0.648 0 C-N-CA 124.975 1.31 . . . . 0.0 110.282 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -64.96 -39.93 94.23 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.599 1.091 . . . . 0.0 111.048 170.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 80.6 m -58.4 -50.95 71.86 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 120.81 1.641 . . . . 0.0 112.488 174.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.27 -41.75 84.97 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.679 1.192 . . . . 0.0 112.224 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 56.7 t90 -66.18 -55.81 14.45 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 125.162 1.385 . . . . 0.0 111.095 177.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 39.3 mt -58.02 -43.57 86.81 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.518 1.053 . . . . 0.0 110.356 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.45 -56.04 27.04 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.53 1.132 . . . . 0.0 112.694 171.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -66.71 -30.47 70.71 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.211 1.005 . . . . 0.0 113.539 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -71.07 -55.3 8.52 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 126.65 1.98 . . . . 0.0 111.23 176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.32 18.43 0.05 OUTLIER Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.372 1.709 . . . . 0.0 117.372 -179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -141.76 63.35 16.35 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 125.558 1.543 . . . . 0.0 113.238 -168.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -63.29 -15.13 46.34 Favored 'Trans proline' 0 CA--C 1.548 1.223 0 C-N-CA 122.235 1.957 . . . . 0.0 113.573 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 30.0 tp60 -70.61 -43.78 68.59 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.544 1.537 . . . . 0.0 113.999 173.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -63.18 -38.46 91.25 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.361 -1.462 . . . . 0.0 112.791 -177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.88 -46.4 78.32 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.86 0.864 . . . . 0.0 110.907 170.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -66.27 -38.17 87.18 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.132 0.973 . . . . 0.0 113.402 177.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 40' ' ' PHE . 2.3 mt -61.81 -33.73 74.65 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.254 0.934 . . . . 0.0 112.432 176.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.456 ' CZ ' HD22 ' A' ' 39' ' ' LEU . 82.0 t80 -78.23 -48.7 15.21 Favored 'General case' 0 C--O 1.224 -0.289 0 O-C-N 121.766 -0.584 . . . . 0.0 112.381 169.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -60.75 -18.35 54.23 Favored 'General case' 0 CA--C 1.549 0.927 0 O-C-N 120.901 -1.124 . . . . 0.0 113.561 178.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -61.13 -56.2 23.54 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.958 1.703 . . . . 0.0 112.833 169.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -165.5 15.39 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 -178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.456 HD22 ' CZ ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 59.96 93.1 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 126.664 1.986 . . . . 0.0 110.275 -167.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.4 ' CD2' HD22 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -88.94 116.3 65.92 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 125.703 1.601 . . . . 0.0 113.796 -177.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -89.9 81.66 0.59 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.782 2.321 . . . . 0.0 111.701 -178.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.24 168.66 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 CA-C-O 121.499 0.666 . . . . 0.0 110.773 176.062 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 39.0 t0 -99.77 128.29 45.87 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.7 mm -53.99 -32.4 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 123.552 0.741 . . . . 0.0 111.187 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.09 -56.36 21.76 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.47 0.577 . . . . 0.0 110.941 172.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.34 -44.23 79.84 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.281 1.032 . . . . 0.0 111.771 173.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -66.83 -42.3 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 118.828 0.74 . . . . 0.0 112.103 -175.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmmt? -65.46 -43.01 91.68 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.474 1.51 . . . . 0.0 111.233 175.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.5 mtt-85 -63.77 -39.78 95.09 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.329 1.052 . . . . 0.0 112.1 175.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -70.13 -35.62 74.22 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.453 1.101 . . . . 0.0 113.255 175.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -79.16 -71.84 0.42 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.913 0.779 . . . . 0.0 112.626 174.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 50.64 -25.92 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 130.56 3.544 . . . . 0.0 118.015 -169.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -64.25 -36.56 84.49 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 128.666 2.786 . . . . 0.0 113.645 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 34.0 mt -70.11 168.79 14.85 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.233 1.413 . . . . 0.0 110.92 173.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 39.8 m-20 -80.61 162.91 24.02 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 120.89 -1.131 . . . . 0.0 112.71 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 12.3 ptt85 -52.82 -36.62 58.87 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.299 1.04 . . . . 0.0 112.91 166.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.07 -38.36 69.45 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 124.598 1.159 . . . . 0.0 111.363 177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.03 -45.87 86.98 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.844 172.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.49 -38.04 81.17 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.715 0 CA-C-O 117.102 -1.428 . . . . 0.0 112.437 172.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -67.37 -39.79 85.7 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 122.149 2.25 . . . . 0.0 112.839 175.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -69.79 -46.27 66.13 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.413 1.085 . . . . 0.0 111.724 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.99 -48.27 82.61 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 125.221 1.408 . . . . 0.0 110.644 172.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.2 t -51.88 -30.81 25.48 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.341 1.457 . . . . 0.0 111.869 171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -48.7 80.04 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 121.982 2.174 . . . . 0.0 112.709 173.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -76.65 -50.91 12.59 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 118.719 -0.658 . . . . 0.0 111.739 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.3 tp -58.13 -44.56 87.84 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-O 116.836 -1.554 . . . . 0.0 112.401 178.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 33.4 t-20 -54.78 -51.35 66.04 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 122.214 2.279 . . . . 0.0 110.328 170.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 4.3 m -51.2 -47.2 62.3 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.903 1.229 . . . . 0.0 112.192 173.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 18.2 mt -69.04 -46.36 68.11 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.991 0.916 . . . . 0.0 112.917 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -66.14 -35.52 80.69 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.056 2.142 . . . . 0.0 112.308 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.1 ttmt -72.6 -54.34 9.39 Favored 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 125.983 1.713 . . . . 0.0 109.912 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 87.7 m -59.78 -18.81 46.29 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 119.364 0.984 . . . . 0.0 113.215 170.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.1 -18.91 52.45 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 119.901 -1.749 . . . . 0.0 115.403 170.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.1 t -104.63 -30.82 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 125.631 1.572 . . . . 0.0 112.163 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.1 21.19 5.33 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.101 1.76 . . . . 0.0 113.939 -173.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.335 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 130.469 3.508 . . . . 0.0 117.053 177.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 ttt . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 119.204 -0.427 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.3 p -76.99 161.57 28.25 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 119.321 0.964 . . . . 0.0 112.412 167.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -153.72 43.07 0.56 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 125.081 1.352 . . . . 0.0 113.021 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mttt -122.86 86.4 2.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.169 1.788 . . . . 0.0 110.782 -169.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.02 153.35 56.06 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.13 0.972 . . . . 0.0 111.933 176.249 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.13 -177.99 2.26 Favored 'Trans proline' 0 CA--C 1.545 1.058 0 C-N-CA 122.96 2.44 . . . . 0.0 111.876 171.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -70.89 35.69 0.05 OUTLIER 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 126.204 1.801 . . . . 0.0 114.307 -179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.1 t -77.6 -34.96 53.28 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 126.432 1.893 . . . . 0.0 113.69 -175.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 3.0 ttt -62.23 -39.2 92.03 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 121.271 -0.893 . . . . 0.0 111.299 174.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.8 mm -73.71 -29.88 27.65 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.361 0 CA-C-O 116.94 -1.505 . . . . 0.0 111.156 174.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.74 -39.97 39.3 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 121.191 1.814 . . . . 0.0 112.151 175.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.2 m -62.36 -40.38 96.24 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 171.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -72.75 -40.45 66.01 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 121.081 -1.012 . . . . 0.0 113.702 173.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.288 1.2 tt -64.2 -40.23 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 CA-C-N 120.209 1.368 . . . . 0.0 109.948 171.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -57.22 -26.13 60.21 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 121.452 1.933 . . . . 0.0 114.009 174.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.05 -48.29 58.47 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 170.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.6 ptmm? -74.76 -36.71 62.57 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.026 -1.046 . . . . 0.0 113.33 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.47 -29.28 70.33 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.853 1.261 . . . . 0.0 110.919 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.435 ' CB ' HD11 ' A' ' 69' ' ' LEU . . . -66.08 -40.46 90.87 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 120.318 1.417 . . . . 0.0 111.355 168.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.7 t -57.79 -48.53 79.43 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.857 1.662 . . . . 0.0 112.152 172.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -60.08 -46.31 90.0 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 173.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -68.39 -52.28 34.77 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 125.49 1.516 . . . . 0.0 111.508 -177.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -56.52 -44.01 80.37 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.411 1.005 . . . . 0.0 110.51 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.2 ttt180 -62.15 -49.04 77.44 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.457 1.103 . . . . 0.0 112.854 175.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -68.44 -30.32 69.17 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.841 1.257 . . . . 0.0 113.418 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 17.8 m -74.4 -55.02 6.45 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.153 1.781 . . . . 0.0 111.576 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 152.38 18.06 0.06 OUTLIER Glycine 0 CA--C 1.538 1.502 0 N-CA-C 117.659 1.824 . . . . 0.0 117.659 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.433 ' HZ ' HD11 ' A' ' 54' ' ' LEU . 72.6 m-85 -140.38 66.67 30.24 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 119.532 1.666 . . . . 0.0 113.42 -168.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -61.26 -16.41 46.44 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 121.93 1.753 . . . . 0.0 113.702 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 21.9 tp60 -71.81 -41.88 67.73 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.767 1.627 . . . . 0.0 114.166 172.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -65.06 -38.23 90.13 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 120.404 1.456 . . . . 0.0 112.622 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.92 -43.75 91.18 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.121 0.568 . . . . 0.0 111.871 168.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -69.14 -36.53 77.55 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -178.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.8 -33.89 73.68 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.545 1.138 . . . . 0.0 112.619 172.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.455 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 76.0 t80 -77.94 -46.46 21.14 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 170.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -61.09 -22.08 64.3 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 121.32 -0.863 . . . . 0.0 112.758 176.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -58.19 -58.07 10.08 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.783 1.633 . . . . 0.0 112.62 172.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -168.12 23.88 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.616 1.71 . . . . 0.0 115.616 -177.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 mp 53.76 87.39 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 126.519 1.928 . . . . 0.0 111.207 -168.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.24 119.0 75.11 Favored Pre-proline 0 CA--C 1.555 1.168 0 C-N-CA 125.058 1.343 . . . . 0.0 114.28 -178.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -91.56 78.6 0.46 Allowed 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 123.397 2.731 . . . . 0.0 111.934 -178.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -85.01 167.43 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 O-C-N 121.496 -0.752 . . . . 0.0 111.263 176.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -94.5 126.6 39.88 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.464 0.705 . . . . 0.0 109.602 168.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.3 mm -53.99 -31.97 21.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.436 -0.79 . . . . 0.0 111.589 170.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.54 -45.24 92.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 119.204 0.911 . . . . 0.0 112.267 173.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.05 -44.59 79.78 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.741 0.7 . . . . 0.0 110.75 173.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -63.51 -41.04 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 118.478 0.581 . . . . 0.0 111.816 -176.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -62.1 -43.56 98.56 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 124.618 1.167 . . . . 0.0 110.93 176.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.5 mtp85 -68.46 -30.91 69.87 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 125.128 1.371 . . . . 0.0 113.381 175.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.0 -36.38 56.44 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.989 1.316 . . . . 0.0 113.295 173.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.439 ' CD2' HD12 ' A' ' 54' ' ' LEU . 0.0 OUTLIER -70.02 -56.82 5.98 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 118.845 -0.597 . . . . 0.0 110.032 175.329 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . 0.274 3.1 p-10 20.66 51.5 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 129.563 3.145 . . . . 0.0 117.155 -172.155 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 39.0 t80 -138.72 -42.7 0.48 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.845 1.258 . . . . 0.0 114.127 -166.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.439 HD12 ' CD2' ' A' ' 51' ' ' HIS . 2.1 mt -87.28 -168.62 2.3 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 127.038 2.135 . . . . 0.0 109.542 -179.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -75.82 161.89 28.62 Favored 'General case' 0 CA--C 1.548 0.867 0 O-C-N 121.306 -0.871 . . . . 0.0 112.314 168.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 47.2 mmt-85 -56.23 -37.05 69.18 Favored 'General case' 0 N--CA 1.482 1.173 0 O-C-N 120.894 -1.129 . . . . 0.0 112.225 166.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -64.16 -36.73 85.0 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.471 1.108 . . . . 0.0 112.079 176.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.23 -40.82 94.58 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.332 -0.855 . . . . 0.0 111.477 174.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -42.99 97.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.309 -1.329 . . . . 0.0 111.957 168.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -61.58 -35.72 78.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 121.775 2.079 . . . . 0.0 112.546 178.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.35 -48.34 42.56 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.977 1.311 . . . . 0.0 112.537 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.2 tp -59.7 -49.18 78.72 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.235 1.414 . . . . 0.0 111.306 174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 34.5 t -48.77 -32.35 8.46 Favored 'General case' 0 C--O 1.217 -0.644 0 C-N-CA 126.321 1.848 . . . . 0.0 111.976 170.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -59.09 -48.9 79.92 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 121.665 2.03 . . . . 0.0 112.943 175.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 9.1 mpt_? -79.49 -43.13 23.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.069 0.947 . . . . 0.0 111.843 178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.34 -46.09 88.23 Favored 'General case' 0 C--O 1.213 -0.844 0 CA-C-O 117.328 -1.32 . . . . 0.0 111.44 177.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 t30 -55.72 -47.02 77.57 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 121.607 2.003 . . . . 0.0 111.528 170.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.5 m -54.0 -45.05 71.36 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-N 119.674 1.125 . . . . 0.0 112.139 174.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.455 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 1.7 mp -68.93 -50.77 46.42 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.54 1.536 . . . . 0.0 112.201 177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 56.9 m-20 -60.93 -30.93 70.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.574 2.35 . . . . 0.0 112.697 176.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -71.78 -53.16 14.26 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.168 1.787 . . . . 0.0 110.521 175.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.87 -30.36 70.81 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 118.732 0.696 . . . . 0.0 112.262 172.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -33.9 75.63 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 115.281 1.586 . . . . 0.0 115.281 173.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.2 m -85.92 -35.05 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 CA-C-N 119.101 0.864 . . . . 0.0 112.201 167.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.0 mmt -97.5 46.63 1.02 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.441 1.896 . . . . 0.0 113.147 -178.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 C-N-CA 128.871 2.868 . . . . 0.0 116.056 170.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 ptp . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.634 -0.698 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 7.3 m -148.07 -64.36 0.25 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 125.124 1.37 . . . . 0.0 112.475 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -131.81 -54.76 1.0 Allowed 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 126.756 2.022 . . . . 0.0 112.788 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.7 pttt -124.57 58.2 1.23 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.858 2.063 . . . . 0.0 110.538 -170.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -53.78 140.59 49.12 Favored Pre-proline 0 C--O 1.249 1.075 0 C-N-CA 126.24 1.816 . . . . 0.0 111.845 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -73.26 -175.3 1.92 Allowed 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 123.715 2.943 . . . . 0.0 111.738 169.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -56.62 -8.05 0.51 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.198 1.799 . . . . 0.0 114.233 172.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.1 t -50.94 -34.73 29.93 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 125.319 1.448 . . . . 0.0 113.928 172.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -61.15 -40.14 92.73 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.452 1.101 . . . . 0.0 111.449 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -74.84 -36.83 40.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 CA-C-O 117.005 -1.474 . . . . 0.0 110.868 170.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -43.25 64.49 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 121.258 1.844 . . . . 0.0 111.643 178.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 m -59.46 -37.8 79.12 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.139 1.376 . . . . 0.0 114.396 170.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -45.92 64.99 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.746 1.619 . . . . 0.0 112.531 173.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . 0.273 0.2 OUTLIER -62.76 -40.98 90.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 119.91 1.232 . . . . 0.0 108.967 176.329 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.74 -11.18 2.88 Favored 'General case' 0 CA--C 1.552 1.054 0 N-CA-C 115.21 1.559 . . . . 0.0 115.21 172.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -88.29 -45.5 9.99 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 120.4 1.455 . . . . 0.0 113.74 166.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.3 ptmt -78.03 -38.44 44.68 Favored 'General case' 0 N--CA 1.481 1.091 0 O-C-N 120.526 -1.359 . . . . 0.0 114.368 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.72 -13.91 59.57 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.358 1.463 . . . . 0.0 110.698 173.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.22 -42.86 83.34 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 120.461 1.482 . . . . 0.0 111.222 156.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.2 t -58.46 -46.78 85.9 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 120.521 1.509 . . . . 0.0 112.925 172.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -62.75 -44.73 95.43 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 53.1 t90 -66.73 -52.15 47.78 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 118.64 -0.695 . . . . 0.0 112.642 -179.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -55.73 -46.99 77.65 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 123.667 0.787 . . . . 0.0 109.655 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 9.2 ttt180 -63.33 -44.37 95.12 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -69.65 -35.09 74.88 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.787 1.235 . . . . 0.0 112.695 177.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 m -68.44 -46.18 70.51 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 127.187 2.195 . . . . 0.0 111.164 175.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 146.49 18.33 0.13 Allowed Glycine 0 CA--C 1.544 1.863 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -141.12 60.26 12.1 Favored Pre-proline 0 CA--C 1.543 0.709 0 CA-C-N 119.438 1.619 . . . . 0.0 114.373 -164.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -59.0 -18.07 41.08 Favored 'Trans proline' 0 CA--C 1.558 1.687 0 C-N-CA 122.859 2.372 . . . . 0.0 114.294 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -66.57 -42.6 86.8 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 127.446 2.298 . . . . 0.0 113.371 173.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -65.08 -40.66 94.95 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 119.16 -2.212 . . . . 0.0 111.571 -174.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.94 -39.46 92.17 Favored 'General case' 0 N--CA 1.441 -0.893 0 N-CA-C 112.524 0.565 . . . . 0.0 112.524 170.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -67.67 -34.81 77.67 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.885 1.274 . . . . 0.0 113.414 178.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.86 -39.06 87.7 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 126.041 1.736 . . . . 0.0 111.847 170.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.447 ' CG ' ' HG ' ' A' ' 69' ' ' LEU . 66.9 t80 -74.45 -44.81 49.97 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 120.915 -1.115 . . . . 0.0 113.309 171.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -61.96 -21.06 64.48 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 121.247 -0.908 . . . . 0.0 112.777 175.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -59.57 -57.4 13.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.768 1.227 . . . . 0.0 112.564 172.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -167.01 20.61 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -178.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.0 mp 58.3 88.05 0.07 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 128.354 2.662 . . . . 0.0 108.938 -169.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.57 119.45 77.48 Favored Pre-proline 0 C--O 1.2 -1.511 0 N-CA-C 115.718 1.748 . . . . 0.0 115.718 178.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -93.69 78.89 0.22 Allowed 'Trans proline' 0 C--N 1.359 1.102 0 C-N-CA 122.009 1.806 . . . . 0.0 110.654 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.53 164.16 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 O-C-N 120.712 -1.242 . . . . 0.0 110.007 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -89.18 129.6 35.74 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.689 0.796 . . . . 0.0 109.866 168.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 39.4 mm -55.34 -37.27 43.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 O-C-N 121.546 -0.721 . . . . 0.0 110.142 170.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.6 t -53.87 -34.86 60.66 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.968 1.258 . . . . 0.0 113.532 174.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.2 tt -71.06 -56.82 5.32 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.037 0.935 . . . . 0.0 110.602 179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 19.7 m -63.92 -35.64 74.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.4 ttmt -60.96 -39.28 88.94 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.471 1.508 . . . . 0.0 110.515 174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.6 -41.16 96.42 Favored 'General case' 0 C--N 1.346 0.455 0 C-N-CA 123.968 0.907 . . . . 0.0 112.968 174.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -75.53 -33.92 60.75 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 178.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 10.8 m80 -98.98 29.22 3.93 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.919 2.088 . . . . 0.0 113.479 176.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -57.9 -17.8 18.93 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 125.146 1.378 . . . . 0.0 114.296 172.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -56.81 -43.09 80.64 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.195 1.798 . . . . 0.0 111.95 170.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.2 mt -73.99 157.49 36.07 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.038 1.335 . . . . 0.0 111.309 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -69.48 160.29 31.7 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 120.879 -1.138 . . . . 0.0 111.985 173.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -29.98 53.53 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.371 1.068 . . . . 0.0 113.735 168.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 -69.07 -44.49 72.47 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.268 1.027 . . . . 0.0 111.731 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.87 -40.34 91.54 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.138 0.575 . . . . 0.0 110.906 175.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.59 -38.93 83.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.726 0 CA-C-O 117.552 -1.213 . . . . 0.0 111.86 172.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.84 -42.7 94.7 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 121.166 1.803 . . . . 0.0 111.436 175.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.39 -46.81 81.71 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.505 1.122 . . . . 0.0 111.74 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -50.06 69.65 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.808 0.843 . . . . 0.0 109.921 175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 35.6 t -49.35 -36.45 21.55 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 112.093 171.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.2 ttp180 -54.66 -47.3 73.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 121.504 1.956 . . . . 0.0 112.77 176.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 53.0 mmt-85 -79.84 -40.82 27.64 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.224 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 1.2 tp -65.01 -47.91 75.78 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-O 117.636 -1.173 . . . . 0.0 112.421 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 38.5 t30 -52.97 -46.87 68.44 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 120.014 1.279 . . . . 0.0 111.308 170.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 1.3 m -55.14 -48.86 73.11 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 119.63 1.105 . . . . 0.0 111.884 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.447 ' HG ' ' CG ' ' A' ' 35' ' ' TYR . 3.1 mp -66.02 -45.71 80.53 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.626 1.571 . . . . 0.0 112.631 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -65.33 -34.4 78.23 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 128.288 2.635 . . . . 0.0 112.702 176.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 19.9 ttmt -73.33 -49.74 25.81 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.493 1.917 . . . . 0.0 110.819 175.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 98.8 m -61.02 -26.64 67.76 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-N 119.834 1.197 . . . . 0.0 113.297 168.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.68 -27.8 65.32 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 120.154 -1.591 . . . . 0.0 114.784 173.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.0 m -95.32 -32.05 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 CA-C-N 120.313 1.415 . . . . 0.0 112.602 170.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 12.5 mmt -96.22 24.61 5.55 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.751 2.02 . . . . 0.0 113.296 -177.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 130.847 3.659 . . . . 0.0 118.269 173.51 . . . . . . . . 2 2 . 1 stop_ save_