data_2mkz_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 2mkz _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 . . . . . 0 C--O 1.253 1.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.4 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.411 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.502 ' O ' HG21 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.564 ' OD1' HD13 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.502 HG21 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.488 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.442 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 61' ' ' ILE . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.466 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.463 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.455 HD13 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.564 HD13 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.411 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp . . . . . 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.514 ' O ' HG11 ' A' ' 25' ' ' VAL . 25.6 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 110.741 -0.096 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.514 HD13 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.514 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' HG21 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HB3' HD11 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.408 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.419 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.631 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.46 HD11 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.509 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.631 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.558 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.458 ' O ' HG11 ' A' ' 25' ' ' VAL . 7.6 t70 . . . . . 0 CA--C 1.486 -1.507 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HB3' ' SD ' ' A' ' 31' ' ' MET . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' O ' HG21 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.609 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.656 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.445 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.518 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.409 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.656 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.421 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.458 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.458 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.462 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.415 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.512 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.495 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 40' ' ' VAL . 32.9 t30 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.521 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.401 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.471 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.42 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.512 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 15.8 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.411 HD12 ' HE3' ' A' ' 31' ' ' MET . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.472 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.424 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.424 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.495 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.42 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.409 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.52 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 . . . . . 0 CA--C 1.485 -1.53 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.444 HD11 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' N ' HD11 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD12 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.473 ' O ' HG21 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.473 HG21 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB3' HD11 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 HD12 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.492 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.408 HD11 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG22 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.492 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.521 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.45 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.45 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.45 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.456 ' HB2' HD12 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.45 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm . . . . . 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' O ' HG11 ' A' ' 25' ' ' VAL . 12.0 t70 . . . . . 0 CA--C 1.489 -1.366 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.494 HG11 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.411 ' HB3' HD12 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.411 HD12 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.495 HD11 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.449 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.41 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt . . . . . 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.464 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.432 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.503 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 53' ' ' SER . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.402 ' H ' ' HG3' ' A' ' 52' ' ' GLU . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.445 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.458 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.503 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.447 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.442 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.464 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.442 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.407 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 58.3 tpp . . . . . 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 25' ' ' VAL . 28.3 t70 . . . . . 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.426 HD13 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.426 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG21 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.42 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.476 ' HB3' HD12 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.584 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.514 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.584 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.496 HD11 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.508 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.508 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.506 ' NE2' HE22 ' A' ' 72' ' ' GLN . 9.9 mm100 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.506 HE22 ' NE2' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.486 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.514 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.514 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.526 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . 0.455 ' HB2' ' HZ3' ' A' ' 113' ' ' LYS . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.526 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp . . . . . 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG13 ' A' ' 25' ' ' VAL . 6.5 t70 . . . . . 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.448 ' HE3' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.458 HD11 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.424 HD11 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.438 HD13 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.416 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.406 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm . . . . . 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.5 -0.965 0 CA-C-O 121.568 0.699 . . . . 0.0 109.856 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.456 ' HE1' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.508 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.486 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.52 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.454 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.496 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.481 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HA ' HD13 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 57' ' ' THR . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.455 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.409 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.66 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.41 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.66 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.508 ' CE2' HG23 ' A' ' 34' ' ' ILE . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 CA--C 1.494 -1.182 0 CA-C-O 120.982 0.42 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG21 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.409 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.551 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HB2' ' OE2' ' A' ' 52' ' ' GLU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.504 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.551 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.47 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.47 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.41 ' HB2' HD12 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 94.7 mmm . . . . . 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.443 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.447 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.41 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' HD12 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.404 ' HB3' HD12 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.486 HD12 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.543 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.412 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.412 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.425 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.425 HD23 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.404 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.434 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.625 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.434 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.625 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.43 ' HB2' HD12 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.43 HD12 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG13 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.409 HG13 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.404 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm . . . . . 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.459 ' O ' HG11 ' A' ' 25' ' ' VAL . 25.0 t70 . . . . . 0 CA--C 1.486 -1.491 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.459 HG11 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.6 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.6 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.477 HG22 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.564 ' SD ' HD11 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.507 ' O ' HG21 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.468 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.424 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.467 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.795 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.795 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.1 p30 -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.46 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.46 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.564 HD11 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.439 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.482 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.482 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.456 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.477 ' SD ' HG22 ' A' ' 30' ' ' ILE . 48.2 ttm . . . . . 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 25' ' ' VAL . 38.1 t70 . . . . . 0 CA--C 1.5 -0.946 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.416 HG12 ' HG ' ' A' ' 26' ' ' LEU . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.416 ' HG ' HG12 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.41 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.432 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.635 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.689 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.479 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . 0.425 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.425 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.41 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm . . . . . 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG13 ' A' ' 25' ' ' VAL . 11.9 t70 . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.181 0.515 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' NE2' ' A' ' 62' ' ' GLN . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG23 ' A' ' 40' ' ' VAL . 30.1 t30 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.413 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.769 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.4 mm-40 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 9.2 p30 -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.477 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.494 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.494 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.449 ' CE1' ' HA ' ' A' ' 34' ' ' ILE . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.518 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.422 ' HB1' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.482 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.476 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.422 ' NE2' ' HB1' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.422 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.692 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.433 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.692 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.46 ' HB2' HD12 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.567 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.567 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.484 ' O ' HG11 ' A' ' 25' ' ' VAL . 17.2 t70 . . . . . 0 CA--C 1.497 -1.087 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.484 HG11 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' THR . . . . . 0.403 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.403 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.452 ' HE3' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.522 ' O ' HG21 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.598 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.473 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.468 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.487 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.487 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm . . . . . 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.0 t70 . . . . . 0 CA--C 1.506 -0.727 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.498 HD13 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.508 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.508 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.585 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.585 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.447 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.425 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.443 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.654 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.443 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG11 ' A' ' 25' ' ' VAL . 21.5 t70 . . . . . 0 CA--C 1.494 -1.207 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' MET . . . . . 0.407 ' HB3' HD12 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.512 ' O ' HG21 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.634 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.548 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.452 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.443 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.47 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.548 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.412 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.503 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.503 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm . . . . . 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.531 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.412 ' HG ' HG11 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.503 ' O ' HG21 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.47 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.548 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.545 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.458 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.476 ' HB3' ' NE2' ' A' ' 85' ' ' GLN . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.476 ' NE2' ' HB3' ' A' ' 83' ' ' SER . 1.3 mp0 -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.419 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.419 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.458 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.596 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' MET . . . . . 0.596 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.505 -0.767 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -136.26 -138.58 0.15 Allowed 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.5 75.57 0.32 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 122.191 0.996 . . . . 0.0 110.062 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.5 111.95 30.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-N 114.124 -1.398 . . . . 0.0 109.432 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 tt -84.89 88.79 7.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.66 101.92 5.17 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.44 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 t -89.79 82.69 6.22 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-O 122.512 1.149 . . . . 0.0 109.51 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -132.28 28.19 4.41 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -80.85 82.67 6.78 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.517 -1.219 . . . . 0.0 111.704 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.475 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 53.3 t -87.58 -51.05 0.42 Allowed Pre-proline 0 C--N 1.301 -1.505 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.03 174.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.475 ' HD3' ' HB ' ' A' ' 10' ' ' VAL . 21.0 Cg_endo -98.85 -169.72 0.11 Allowed 'Trans proline' 0 N--CA 1.437 -1.824 0 C-N-CA 121.597 1.531 . . . . 0.0 110.867 174.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.89 152.27 28.1 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.16 96.2 0.1 Allowed Glycine 0 N--CA 1.427 -1.953 0 C-N-CA 118.731 -1.7 . . . . 0.0 113.244 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.29 153.98 56.33 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 121.979 1.786 . . . . 0.0 109.704 173.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.43 93.57 3.48 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -178.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.81 -164.6 40.14 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.178 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -115.66 138.59 14.74 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -93.64 -34.35 13.32 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.424 -177.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.59 -59.23 2.3 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -178.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -92.87 106.78 18.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.72 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -74.43 114.3 12.66 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.295 179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.4 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.411 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.502 ' O ' HG21 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.564 ' OD1' HD13 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.502 HG21 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.488 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.466 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.442 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.494 ' O ' HG13 ' A' ' 61' ' ' ILE . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.476 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.476 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.453 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.466 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.463 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.455 HD13 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.564 HD13 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.507 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.411 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.468 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.463 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.422 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp -58.57 -59.88 4.68 Favored 'General case' 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.422 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.319 2.2 pp0? -77.96 -6.49 54.59 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.793 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -89.37 -36.04 15.73 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.312 174.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -99.37 -38.9 8.65 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.62 14.28 13.69 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -51.02 110.64 1.85 Allowed Pre-proline 0 C--O 1.247 0.944 0 C-N-CA 126.407 1.883 . . . . 0.0 109.373 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.78 77.13 4.2 Favored 'Trans proline' 0 N--CA 1.432 -2.121 0 C-N-CA 122.342 2.028 . . . . 0.0 112.994 -175.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -121.72 9.52 10.15 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 46.55 59.28 3.98 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 126.261 1.824 . . . . 0.0 113.518 -177.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -92.64 96.25 10.07 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -139.6 113.47 8.69 Favored 'General case' 0 C--N 1.284 -2.272 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.47 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 113.56 42.62 0.87 Allowed Glycine 0 C--N 1.297 -1.621 0 C-N-CA 120.325 -0.941 . . . . 0.0 113.617 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -78.82 100.97 7.39 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.182 0.992 . . . . 0.0 109.255 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 53.4 m -149.94 134.93 17.86 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.642 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -89.99 72.95 7.4 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.291 0.567 . . . . 0.0 111.772 177.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -122.44 3.95 9.67 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -152.44 166.3 32.35 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -178.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt 82.98 123.38 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.906 1.682 . . . . 0.0 110.486 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.25 85.66 3.74 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -81.92 -13.95 56.81 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.387 0.613 . . . . 0.0 110.551 -176.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -125.37 105.8 9.36 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.98 172.8 6.63 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.374 -175.37 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -90.92 174.23 7.55 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.8 tpt -116.03 -23.37 8.55 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 121.112 0.482 . . . . 0.0 110.515 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.5 t -83.44 110.96 18.6 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.224 -174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 85.8 mt 69.89 -42.12 0.5 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.678 1.591 . . . . 0.0 114.768 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 C--N 1.301 -1.506 0 C-N-CA 123.203 0.601 . . . . 0.0 111.379 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -56.46 -63.24 1.26 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.993 0.517 . . . . 0.0 111.15 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.63 -50.88 0.13 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.508 HD13 ' N ' ' A' ' 5' ' ' LEU . 2.4 pp -52.25 -32.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -171.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.508 ' N ' HD13 ' A' ' 4' ' ' ILE . 56.4 tp -142.06 98.14 3.27 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.17 69.25 1.0 Allowed 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 m -90.55 -46.37 8.35 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.82 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -83.74 61.22 6.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.582 0.706 . . . . 0.0 112.596 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -174.79 -179.49 1.46 Allowed 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.801 0.84 . . . . 0.0 110.644 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.46 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 17.3 m -88.2 174.15 5.49 Favored Pre-proline 0 C--N 1.303 -1.455 0 C-N-CA 124.298 1.039 . . . . 0.0 108.5 175.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.46 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 5.6 Cg_exo -38.39 -52.4 1.96 Allowed 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 124.13 3.22 . . . . 0.0 113.153 175.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.53 171.75 0.19 Allowed 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.592 1.157 . . . . 0.0 113.449 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.76 121.0 0.95 Allowed Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.332 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -55.57 -45.09 42.12 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.475 2.117 . . . . 0.0 110.976 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.69 99.55 8.48 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -79.21 77.64 1.81 Allowed Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.81 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.79 152.93 23.9 Favored Glycine 0 N--CA 1.43 -1.765 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -115.61 147.73 40.44 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 117.194 0.497 . . . . 0.0 111.605 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -150.21 153.32 36.04 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.5 t 55.96 82.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 124.389 1.055 . . . . 0.0 110.367 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.514 ' O ' HG11 ' A' ' 25' ' ' VAL . 25.6 t70 -66.44 124.06 21.71 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.514 HD13 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.514 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' HG21 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.46 ' HB3' HD11 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.408 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.419 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.631 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.46 HD11 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.509 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.422 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.415 ' HA3' ' CG1' ' A' ' 4' ' ' ILE . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.631 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.407 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.435 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.558 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm -66.02 -57.09 8.54 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.275 0.3 OUTLIER -67.45 -26.64 66.49 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -175.9 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.31 -30.69 25.36 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.441 -0.903 . . . . 0.0 112.535 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.69 -39.13 15.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.445 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.86 68.95 7.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.956 0.884 . . . . 0.0 111.422 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -168.83 117.78 0.6 Allowed Pre-proline 0 C--N 1.301 -1.539 0 CA-C-N 113.62 -1.627 . . . . 0.0 107.248 173.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -73.33 -45.97 0.39 Allowed 'Trans proline' 0 CA--C 1.517 -0.363 0 C-N-CA 122.108 1.872 . . . . 0.0 111.354 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 65.89 179.78 0.2 Allowed 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.633 1.173 . . . . 0.0 111.045 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.495 ' NE2' ' HB2' ' A' ' 125' ' ' GLU . 5.9 tt0 -98.76 -39.11 8.8 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.414 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt 46.43 74.35 0.15 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.263 1.425 . . . . 0.0 112.79 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.495 ' HB2' ' NE2' ' A' ' 123' ' ' GLN . 33.1 tt0 -88.96 -69.66 0.7 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.437 -175.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 71.33 -88.73 0.42 Allowed Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.489 ' OD2' ' HG3' ' A' ' 129' ' ' LYS . 27.0 t70 -161.41 -60.83 0.05 Allowed 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 m 56.22 82.77 0.1 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.89 -1.505 . . . . 0.0 113.165 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.489 ' HG3' ' OD2' ' A' ' 127' ' ' ASP . 62.0 mttp -96.99 113.03 24.53 Favored 'General case' 0 CA--C 1.499 -1.004 0 O-C-N 121.491 -0.755 . . . . 0.0 110.535 175.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -95.43 6.37 49.16 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.102 -0.954 . . . . 0.0 108.99 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -74.0 81.02 1.7 Allowed 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -102.6 95.3 6.14 Favored 'General case' 0 N--CA 1.415 -2.181 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 167.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -100.95 -4.36 27.76 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.723 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.12 138.06 51.62 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 113.269 -1.787 . . . . 0.0 109.54 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -117.41 111.16 18.94 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 71.06 101.23 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.412 1.085 . . . . 0.0 110.368 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -94.51 105.29 17.25 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 86.4 mtp -131.8 126.66 34.91 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.818 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -107.87 29.3 7.38 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 175.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp 61.23 64.26 1.12 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.533 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 CA--C 1.495 -1.142 0 CA-C-N 113.03 -1.896 . . . . 0.0 107.762 -176.211 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.1 p . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 120.939 0.4 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -153.77 127.21 8.6 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.824 0.85 . . . . 0.0 108.938 177.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.35 -39.03 0.44 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.541 1.536 . . . . 0.0 113.865 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.28 129.59 32.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 C-N-CA 125.051 1.34 . . . . 0.0 111.229 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -115.6 156.2 26.25 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.33 -6.61 25.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -174.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.8 p -90.26 -1.7 57.95 Favored 'General case' 0 C--N 1.305 -1.326 0 C-N-CA 122.972 0.509 . . . . 0.0 110.154 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.8 mmt 61.04 68.01 0.77 Allowed 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.842 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -137.78 136.5 37.31 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.0 t 62.74 95.39 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.535 0 O-C-N 124.136 0.897 . . . . 0.0 109.403 -173.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -79.62 3.59 7.4 Favored 'Trans proline' 0 C--N 1.336 -0.12 0 C-N-CA 122.933 2.422 . . . . 0.0 113.783 -174.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.35 99.54 0.04 OUTLIER 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.483 1.113 . . . . 0.0 111.002 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.11 161.04 34.44 Favored Glycine 0 N--CA 1.422 -2.258 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -81.27 40.01 0.93 Allowed 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.267 2.645 . . . . 0.0 111.283 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.73 110.52 5.62 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.126 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -155.37 119.29 0.91 Allowed Glycine 0 N--CA 1.422 -2.293 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.57 -59.03 4.13 Favored Glycine 0 C--O 1.241 0.572 0 C-N-CA 121.829 -0.224 . . . . 0.0 113.348 177.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 69.32 169.09 0.29 Allowed 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.502 1.521 . . . . 0.0 112.372 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 65.38 -81.84 0.03 OUTLIER 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 110.909 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.1 t -128.38 77.88 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.458 ' O ' HG11 ' A' ' 25' ' ' VAL . 7.6 t70 -96.43 132.05 42.36 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.154 175.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HB3' ' SD ' ' A' ' 31' ' ' MET . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' O ' HG21 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.471 HG21 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.542 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.609 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.656 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.445 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.518 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.518 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.409 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.656 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.421 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.409 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.458 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.458 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.462 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.462 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.449 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt -58.49 -52.03 67.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.299 0.4 OUTLIER -69.23 -31.16 69.54 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -177.071 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -92.41 -19.18 22.33 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.142 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 -34.94 12.17 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.806 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.75 71.66 9.56 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 122.322 1.058 . . . . 0.0 108.161 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -111.43 136.24 21.0 Favored Pre-proline 0 C--N 1.287 -2.11 0 CA-C-N 113.196 -1.82 . . . . 0.0 110.551 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -70.38 -32.67 15.59 Favored 'Trans proline' 0 C--O 1.251 1.157 0 C-N-CA 122.487 2.125 . . . . 0.0 111.561 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 66.84 160.09 0.14 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.119 1.368 . . . . 0.0 113.706 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.36 -47.07 5.29 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 68.57 -73.99 0.08 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.222 1.409 . . . . 0.0 113.24 175.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.94 81.13 3.49 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.274 1.035 . . . . 0.0 112.361 -174.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 158.33 39.88 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.96 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.137 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.41 -80.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.048 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 33.0 m 54.98 81.79 0.1 Allowed 'General case' 0 C--O 1.247 0.949 0 C-N-CA 123.663 0.785 . . . . 0.0 111.552 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -80.75 74.48 7.69 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.526 1.155 . . . . 0.0 111.382 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -78.26 -38.18 43.34 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 113.533 -1.667 . . . . 0.0 107.758 177.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -127.18 175.84 7.84 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.011 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.25 -169.28 2.55 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 103.214 -2.884 . . . . 0.0 103.214 174.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -73.73 -55.28 6.44 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -142.65 164.81 29.1 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 170.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -108.59 9.31 27.31 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.623 1.201 . . . . 0.0 109.812 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.72 166.46 7.96 Favored 'General case' 0 C--N 1.296 -1.761 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.452 ' OD1' HD23 ' A' ' 140' ' ' LEU . 12.4 t70 -122.09 113.41 19.49 Favored 'General case' 0 C--N 1.282 -2.369 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -9.36 57.2 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -176.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 8.7 m -91.78 -50.49 5.71 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.452 HD23 ' OD1' ' A' ' 137' ' ' ASP . 2.3 pt? -127.21 98.91 5.46 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.537 0.684 . . . . 0.0 111.492 176.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 C--N 1.298 -1.658 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.588 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 N--CA 1.438 -1.03 0 CA-C-O 120.954 0.407 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -127.93 125.7 40.07 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.63 45.46 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.694 0.283 . . . . 0.0 111.701 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 66.9 mt -81.08 88.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -133.75 111.12 10.29 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -112.42 -10.14 13.78 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 173.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.8 t 178.47 -177.64 0.25 Allowed 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.4 mtt -82.3 68.05 8.57 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 120.221 1.373 . . . . 0.0 110.849 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 176.59 139.94 0.07 Allowed 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.5 m -88.27 121.54 70.31 Favored Pre-proline 0 N--CA 1.437 -1.082 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.303 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.3 -0.22 10.55 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.384 2.056 . . . . 0.0 112.629 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.61 94.03 6.75 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.95 -134.1 8.37 Favored Glycine 0 N--CA 1.432 -1.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.936 -178.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.01 -42.32 30.97 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 122.493 2.129 . . . . 0.0 111.343 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 64.82 22.86 12.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.379 1.072 . . . . 0.0 111.777 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -104.82 147.81 16.44 Favored Glycine 0 N--CA 1.429 -1.806 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.039 -176.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.83 77.96 1.16 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 63.89 -90.03 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.232 1.013 . . . . 0.0 109.726 -174.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -128.39 5.89 5.75 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.112 0.482 . . . . 0.0 110.115 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.26 105.75 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.3 121.07 16.94 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.415 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.512 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.445 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.495 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.469 ' O ' HG22 ' A' ' 40' ' ' VAL . 32.9 t30 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.521 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.401 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.471 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.51 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.42 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.42 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.441 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.512 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 15.8 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.411 HD12 ' HE3' ' A' ' 31' ' ' MET . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.472 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.424 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.42 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.645 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.424 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.645 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.495 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.42 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.43 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.43 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.409 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm -63.05 -45.22 93.26 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.277 0.1 OUTLIER -72.57 -22.51 60.99 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -99.77 -8.85 23.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 118.297 -1.361 . . . . 0.0 111.778 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -115.25 -51.89 2.69 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.23 -22.33 28.72 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.672 0.749 . . . . 0.0 110.636 -173.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 58.6 tptt -106.98 120.52 47.76 Favored Pre-proline 0 C--N 1.291 -1.948 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -72.42 55.52 2.56 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.207 1.938 . . . . 0.0 114.283 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -83.78 -23.53 31.46 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.841 0.829 . . . . 0.0 108.981 175.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -127.01 130.8 50.72 Favored 'General case' 0 N--CA 1.426 -1.662 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.486 ' HB3' ' HZ2' ' A' ' 124' ' ' LYS . 6.5 mtpm? -136.8 -63.64 0.61 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.306 0.574 . . . . 0.0 112.415 -174.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -61.23 103.35 0.28 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.615 -169.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -115.39 -13.46 8.91 Favored Glycine 0 C--N 1.309 -0.924 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -103.3 86.77 2.73 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 45.6 m -143.58 133.14 23.56 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.16 -39.84 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.125 0.266 . . . . 0.0 111.226 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 32.6 t70 42.62 -87.93 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.492 1.917 . . . . 0.0 114.374 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -151.31 171.79 16.91 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.77 0.795 . . . . 0.0 109.694 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -124.08 85.3 2.39 Favored 'General case' 0 N--CA 1.414 -2.265 1 N-CA-C 100.029 -4.063 . . . . 0.0 100.029 165.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.1 -25.98 68.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.147 -1.388 . . . . 0.0 114.327 -164.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -70.31 162.51 28.4 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -73.02 82.96 1.25 Allowed 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.505 0.669 . . . . 0.0 112.038 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 76.99 159.12 0.21 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.815 2.046 . . . . 0.0 109.71 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -73.01 -17.23 61.47 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.794 0.807 . . . . 0.0 109.976 178.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 62.0 mtt 72.96 -81.96 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.676 1.591 . . . . 0.0 114.003 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 19.8 m 62.93 14.13 7.22 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.94 0.896 . . . . 0.0 112.397 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.7 pp -99.55 -15.49 18.61 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.688 -177.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.25 1.104 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 177.636 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.2 t . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -104.84 -11.47 16.75 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.86 -16.78 0.44 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.535 1.534 . . . . 0.0 113.233 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mt -83.42 84.55 1.87 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-O 121.67 0.747 . . . . 0.0 109.137 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 tt -133.14 80.36 1.88 Allowed 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.47 104.51 16.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.365 -177.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.5 m -85.22 -33.85 22.14 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -121.53 88.52 2.95 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.915 177.415 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -125.71 72.32 1.27 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.992 0.901 . . . . 0.0 108.825 172.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -137.9 112.09 8.86 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -178.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.27 -67.95 0.04 OUTLIER 'Trans proline' 0 C--O 1.243 0.744 0 C-N-CA 121.8 1.667 . . . . 0.0 111.338 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.99 175.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.682 1.193 . . . . 0.0 112.777 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 134.16 139.89 4.21 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.344 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -77.49 146.36 24.37 Favored 'Trans proline' 0 C--O 1.245 0.846 0 C-N-CA 122.609 2.206 . . . . 0.0 111.898 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.76 -68.84 0.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.818 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 131.68 -162.45 23.78 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.59 8.07 7.8 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.027 178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -70.77 -42.55 70.25 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.879 0.371 . . . . 0.0 110.398 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -129.58 127.54 40.88 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 173.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t 64.74 82.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 124.284 0.99 . . . . 0.0 108.593 -172.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.52 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 -93.73 121.58 35.31 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.288 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.444 HD11 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.444 ' N ' HD11 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.52 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD12 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.473 ' O ' HG21 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.473 HG21 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB3' HD11 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 HD12 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.492 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.408 HD11 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.495 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG22 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.492 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.521 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.45 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.45 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.45 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.456 ' HB2' HD12 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.456 HD12 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.45 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.455 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.419 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.455 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm -58.36 -58.6 7.78 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.572 ' O ' ' HB3' ' A' ' 120' ' ' LYS 0.316 3.5 pp0? -75.45 -5.84 47.1 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -177.832 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -93.69 -10.54 34.08 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 121.44 -0.788 . . . . 0.0 111.467 173.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -114.66 -52.97 2.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.079 0.466 . . . . 0.0 111.09 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.61 83.63 2.12 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.572 ' HB3' ' O ' ' A' ' 116' ' ' GLN . 19.8 pttp -105.97 120.89 47.52 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.22 -176.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.1 8.59 4.54 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.408 2.072 . . . . 0.0 112.566 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -26.09 25.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -160.21 130.26 5.34 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -113.9 161.33 17.76 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.297 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 68.6 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.243 1.417 . . . . 0.0 112.475 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.41 146.67 20.98 Favored Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 109.841 -1.304 . . . . 0.0 109.841 -176.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -133.73 164.88 26.24 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 p -66.36 -77.63 0.06 Allowed 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 124.136 0.898 . . . . 0.0 111.753 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? 54.43 36.49 25.66 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -177.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -63.31 -52.57 61.36 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.715 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 57.68 -174.06 0.08 Allowed 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.119 0.967 . . . . 0.0 112.256 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -126.89 81.8 2.04 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.33 -55.44 3.66 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -74.82 108.76 7.77 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 171.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.83 -61.05 1.94 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 53.82 91.16 0.03 OUTLIER 'General case' 0 C--O 1.239 0.517 0 C-N-CA 125.393 1.477 . . . . 0.0 112.224 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -102.92 128.27 49.79 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' MET . . . . . 0.471 ' HB2' ' O ' ' A' ' 141' ' ' ASP . 25.9 ptt? -78.93 87.33 4.76 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.299 1.047 . . . . 0.0 109.267 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -107.94 -47.38 3.59 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.342 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.9 tt -80.43 -47.28 14.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 138' ' ' MET . 37.2 t70 . . . . . 0 N--CA 1.434 -1.23 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.66 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.412 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 6.2 m . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -93.32 133.9 36.09 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.906 0.384 . . . . 0.0 110.071 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -89.21 -30.79 18.28 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 pt -80.48 89.56 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-O 122.736 1.255 . . . . 0.0 109.603 174.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.1 mt -85.29 91.89 8.29 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-N 114.022 -1.445 . . . . 0.0 108.787 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.98 15.78 24.97 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.574 -177.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.1 p -88.31 -8.03 55.78 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.989 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 87.4 mtp 69.62 23.51 5.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.176 0.99 . . . . 0.0 111.275 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -96.95 141.3 30.3 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.51 107.16 55.19 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.49 -46.93 1.67 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.174 1.916 . . . . 0.0 111.058 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.46 61.6 6.68 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.577 0.703 . . . . 0.0 110.282 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -120.0 102.97 0.91 Allowed Glycine 0 N--CA 1.437 -1.264 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.99 120.86 8.52 Favored 'Trans proline' 0 C--O 1.248 0.991 0 C-N-CA 123.104 2.536 . . . . 0.0 112.75 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -157.69 104.44 1.96 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.67 133.74 5.52 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.201 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.64 170.96 13.48 Favored Glycine 0 C--N 1.298 -1.56 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -90.38 173.04 8.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 117.074 0.437 . . . . 0.0 110.839 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 68.19 -88.68 0.03 OUTLIER 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.684 1.194 . . . . 0.0 111.94 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -121.82 96.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' O ' HG11 ' A' ' 25' ' ' VAL . 12.0 t70 -99.93 98.9 9.62 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 173.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.494 HG11 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.411 ' HB3' HD12 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.411 HD12 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.527 ' O ' HG23 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.436 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.527 HG23 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.436 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.495 HD11 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.405 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.43 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.412 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.449 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.41 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.588 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt -61.65 -59.3 5.4 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.271 3.6 pp0? -73.51 -22.8 60.03 Favored 'General case' 0 C--O 1.2 -1.515 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.306 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -73.68 -22.17 60.02 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.485 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -98.16 -36.63 10.0 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.239 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.67 87.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -116.15 105.38 50.99 Favored Pre-proline 0 N--CA 1.431 -1.408 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.6 49.71 0.52 Allowed 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.446 2.764 . . . . 0.0 112.712 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -55.75 -25.05 38.74 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.33 166.39 24.9 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.385 172.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -148.05 140.34 24.3 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.64 -16.76 21.84 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.283 0.563 . . . . 0.0 110.27 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 130.45 118.24 2.0 Favored Glycine 0 N--CA 1.423 -2.207 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.069 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.48 ' O ' ' HB ' ' A' ' 128' ' ' THR . 9.2 t70 -81.33 146.7 30.23 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' THR . . . . . 0.48 ' HB ' ' O ' ' A' ' 127' ' ' ASP . 95.8 m 77.8 -20.23 0.39 Allowed 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 123.252 0.621 . . . . 0.0 112.307 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 65.66 83.42 0.17 Allowed 'General case' 0 CA--C 1.506 -0.726 0 C-N-CA 124.374 1.07 . . . . 0.0 109.374 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -113.07 135.21 54.05 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.244 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 38.8 mttp 67.83 71.08 0.33 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.379 1.072 . . . . 0.0 108.433 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -79.82 -26.11 40.59 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -117.3 151.71 36.4 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.16 140.54 31.68 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.24 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -83.59 -37.07 23.4 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.077 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 67.14 111.76 0.04 OUTLIER 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.589 1.156 . . . . 0.0 111.64 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -79.56 -69.39 0.58 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.541 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 53.4 ttm -154.92 102.48 2.34 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-O 121.436 0.636 . . . . 0.0 111.815 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.5 m -91.0 98.18 11.62 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 115.136 -0.938 . . . . 0.0 108.719 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 62.1 tp -177.35 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.5 179.034 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.3 t30 74.55 149.35 0.1 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.166 0.986 . . . . 0.0 109.683 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.89 -47.35 83.69 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.808 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 80.2 mt 69.8 -59.24 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 125.275 1.43 . . . . 0.0 112.164 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.9 tp 72.33 -51.46 0.7 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.424 1.49 . . . . 0.0 112.53 177.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.78 14.31 7.21 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.587 1.155 . . . . 0.0 112.571 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.5 m -99.05 156.84 16.72 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.4 ttp 71.17 19.69 5.38 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 122.906 1.336 . . . . 0.0 109.229 -177.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -146.46 87.11 1.7 Allowed 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.18 93.36 5.48 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -172.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.523 ' HD2' ' OE1' ' A' ' 72' ' ' GLN . 26.5 Cg_exo -66.67 -37.38 21.68 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.167 1.911 . . . . 0.0 110.12 168.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 70.86 158.32 0.18 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.311 1.444 . . . . 0.0 113.15 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.05 108.78 0.21 Allowed Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -79.44 -22.87 7.76 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.04 1.827 . . . . 0.0 112.192 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.08 19.56 8.77 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.575 1.15 . . . . 0.0 111.492 -178.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -159.6 -113.82 0.35 Allowed Glycine 0 N--CA 1.425 -2.057 0 N-CA-C 106.243 -2.743 . . . . 0.0 106.243 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.95 -66.69 0.54 Allowed Glycine 0 C--N 1.305 -1.176 0 C-N-CA 119.308 -1.425 . . . . 0.0 113.862 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -70.43 -49.05 52.83 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.931 0.872 . . . . 0.0 109.182 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.82 168.9 18.67 Favored 'General case' 0 N--CA 1.416 -2.151 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t 65.95 89.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 O-C-N 124.812 1.32 . . . . 0.0 111.723 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -97.1 98.63 10.21 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.512 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.464 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.512 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.432 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.478 HD12 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.503 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.402 ' HG3' ' H ' ' A' ' 53' ' ' SER . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.402 ' H ' ' HG3' ' A' ' 52' ' ' GLU . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.445 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.458 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.523 ' OE1' ' HD2' ' A' ' 11' ' ' PRO . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.503 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.447 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.443 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.442 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.464 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.442 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.408 ' HB2' HD11 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.408 HD11 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.407 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.407 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.447 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 58.3 tpp -62.37 -58.51 7.39 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.266 3.9 pp0? -66.75 -19.52 65.77 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -90.39 -18.54 25.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.162 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -102.82 -56.6 2.2 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -107.7 83.77 1.85 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-O 122.2 1.0 . . . . 0.0 110.712 -172.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.443 ' HG3' ' HB2' ' A' ' 122' ' ' GLU . 16.6 tppt? -111.89 104.11 55.77 Favored Pre-proline 0 C--N 1.276 -2.618 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.038 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -76.91 53.32 4.1 Favored 'Trans proline' 0 N--CA 1.482 0.814 0 C-N-CA 123.557 2.838 . . . . 0.0 111.28 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.443 ' HB2' ' HG3' ' A' ' 120' ' ' LYS . 0.9 OUTLIER -63.89 -67.79 0.4 Allowed 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.218 1.407 . . . . 0.0 111.011 -176.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.478 ' CD ' ' H ' ' A' ' 124' ' ' LYS 0.498 0.0 OUTLIER 29.88 -105.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 -175.244 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 0.0 OUTLIER -173.54 105.42 0.13 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.553 0.741 . . . . 0.0 109.996 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.59 -50.89 3.32 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.042 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.05 10.02 24.96 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.291 -175.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' A' ' 124' ' ' LYS . 7.4 t70 -144.85 177.16 8.93 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.8 m -106.36 -32.95 7.91 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt 49.02 78.91 0.08 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.256 1.023 . . . . 0.0 112.851 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -156.77 140.95 16.46 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -112.49 124.76 53.23 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -143.69 -29.08 0.52 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.995 168.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -131.78 96.92 4.05 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.993 0.425 . . . . 0.0 111.571 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -137.2 112.64 9.31 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 72.84 -70.01 0.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.023 1.329 . . . . 0.0 110.592 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -155.32 177.23 11.59 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -100.09 148.97 23.99 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.3 ptm -72.4 88.12 1.19 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.725 1.25 . . . . 0.0 111.585 -176.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 3.0 p -110.94 -68.09 0.95 Allowed 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 114.506 -1.225 . . . . 0.0 111.282 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.57 -26.77 34.71 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 122.115 0.96 . . . . 0.0 108.925 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.264 1.861 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.483 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' OD1' HG12 ' A' ' 4' ' ' ILE . 45.3 t30 67.29 96.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.385 1.074 . . . . 0.0 112.504 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.5 72.67 1.5 Allowed 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.889 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.427 HG12 ' OD1' ' A' ' 2' ' ' ASN . 34.9 pt -129.31 5.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.879 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.55 120.61 30.05 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.09 116.21 32.19 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.286 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -100.3 -105.43 0.23 Allowed 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.2 ttt -95.66 -43.33 7.96 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 168.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -82.1 143.92 31.15 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.6 p -129.95 101.42 18.23 Favored Pre-proline 0 C--N 1.291 -1.962 0 CA-C-O 121.046 0.451 . . . . 0.0 110.903 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -73.05 -42.09 1.12 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.094 1.196 . . . . 0.0 110.077 176.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.79 -177.47 0.36 Allowed 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.95 179.03 18.43 Favored Glycine 0 N--CA 1.431 -1.698 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -84.93 91.31 0.75 Allowed 'Trans proline' 0 N--CA 1.437 -1.84 0 C-N-CA 122.238 1.959 . . . . 0.0 111.241 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.23 121.14 26.26 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.828 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.15 -75.88 1.87 Allowed Glycine 0 N--CA 1.433 -1.548 0 N-CA-C 111.179 -0.768 . . . . 0.0 111.179 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.8 26.73 21.58 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.594 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 65.77 173.34 0.23 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.229 1.012 . . . . 0.0 112.68 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -91.58 -23.45 19.89 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -100.93 96.66 4.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.494 ' O ' HG13 ' A' ' 25' ' ' VAL . 28.3 t70 -89.83 116.45 27.93 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.426 HD13 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.426 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG21 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.525 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.42 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.476 ' HB3' HD12 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.525 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.466 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.486 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.476 HD12 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.584 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.514 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.584 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.496 HD11 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.508 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.508 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.506 ' NE2' HE22 ' A' ' 72' ' ' GLN . 9.9 mm100 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.506 HE22 ' NE2' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.486 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.514 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.684 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.514 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.684 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.526 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.455 ' HB2' ' HZ3' ' A' ' 113' ' ' LYS . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.526 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp -68.04 -55.01 14.12 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.281 0.6 OUTLIER -61.33 -26.29 67.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -176.547 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -84.35 -57.0 3.34 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.19 0.519 . . . . 0.0 111.628 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -86.97 -11.24 51.12 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.82 5.8 20.42 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.151 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -101.16 95.08 4.42 Favored Pre-proline 0 C--N 1.31 -1.13 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.72 -21.71 16.25 Favored 'Trans proline' 0 C--O 1.241 0.655 0 C-N-CA 122.569 2.179 . . . . 0.0 114.189 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 68.01 -87.57 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.648 1.179 . . . . 0.0 111.833 -177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.53 ' NE2' ' HB2' ' A' ' 125' ' ' GLU . 2.9 pt20 -149.77 170.86 17.75 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -74.7 -42.57 58.15 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.925 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.53 ' HB2' ' NE2' ' A' ' 123' ' ' GLN . 75.4 mm-40 -67.07 127.4 32.45 Favored 'General case' 0 N--CA 1.425 -1.686 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -175.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.82 77.43 1.99 Allowed Glycine 0 C--N 1.29 -2.002 0 N-CA-C 106.724 -2.55 . . . . 0.0 106.724 169.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.12 -36.16 83.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 122.973 0.509 . . . . 0.0 111.336 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.7 m -66.1 130.68 44.09 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -82.48 88.95 6.6 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -171.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -111.75 95.45 5.5 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.556 ' O ' ' HG2' ' A' ' 132' ' ' LYS . 54.4 tttm -113.8 -16.48 12.25 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.969 -175.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.556 ' HG2' ' O ' ' A' ' 131' ' ' LYS . 5.2 ptpp? 89.31 9.62 0.09 Allowed 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 128.05 2.54 . . . . 0.0 108.199 -171.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -129.77 110.84 12.07 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.897 -1.501 . . . . 0.0 108.451 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.44 84.77 4.58 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 122.257 1.027 . . . . 0.0 108.643 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -88.25 86.32 7.06 Favored 'General case' 0 N--CA 1.414 -2.231 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.449 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -84.04 171.95 12.45 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 113.462 -1.699 . . . . 0.0 109.135 -177.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.81 96.88 10.35 Favored 'General case' 0 CA--C 1.484 -1.583 0 C-N-CA 118.998 -1.081 . . . . 0.0 108.563 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.4 ttt -115.6 79.18 1.26 Allowed 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.7 p -80.07 -55.73 4.74 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.972 -1.467 . . . . 0.0 112.085 -173.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -158.2 88.96 0.97 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.422 0.63 . . . . 0.0 110.932 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--N 1.299 -1.624 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 175.918 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.889 0.376 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -83.36 -23.45 32.46 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 122.992 0.517 . . . . 0.0 109.788 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.38 -69.23 0.19 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.793 1.637 . . . . 0.0 112.655 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -87.94 156.6 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.055 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.705 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mp -99.04 -10.49 22.55 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 74.03 -45.92 0.61 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.834 1.654 . . . . 0.0 109.998 -174.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 m 60.68 24.54 14.34 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 122.683 1.23 . . . . 0.0 109.804 176.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.2 tpt -119.63 1.42 11.11 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.468 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 p30 52.51 26.33 4.19 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 126.04 1.736 . . . . 0.0 113.843 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.8 t -128.55 119.67 20.49 Favored Pre-proline 0 C--N 1.311 -1.106 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -65.96 -33.55 41.76 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.945 1.764 . . . . 0.0 111.96 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 71.15 152.92 0.12 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.285 1.434 . . . . 0.0 113.059 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.98 89.57 0.42 Allowed Glycine 0 N--CA 1.435 -1.403 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 178.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.06 -41.65 65.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.196 2.598 . . . . 0.0 112.428 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 58.56 -166.26 0.16 Allowed 'General case' 0 C--O 1.252 1.202 0 C-N-CA 124.265 1.026 . . . . 0.0 112.657 178.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.42 64.67 0.16 Allowed Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.09 -174.08 47.19 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -173.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -91.56 73.32 5.95 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 118.407 1.104 . . . . 0.0 112.069 178.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -83.37 171.19 13.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 114.9 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG13 ' A' ' 25' ' ' VAL . 6.5 t70 -77.27 129.96 36.58 Favored 'General case' 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.448 ' HE3' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.458 HD11 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.424 HD11 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.487 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.565 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.565 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.438 HD13 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.416 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.406 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.406 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.419 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm -60.1 -57.31 13.39 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -81.24 -5.91 58.28 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 119.823 -0.751 . . . . 0.0 112.911 -176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -83.26 -39.08 21.33 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.939 171.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -80.87 -58.62 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.952 0.406 . . . . 0.0 110.595 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.5 45.25 1.25 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -65.04 115.91 25.32 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.181 -175.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -75.76 69.76 6.01 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.792 2.328 . . . . 0.0 110.47 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -146.22 -50.22 0.22 Allowed 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -108.44 -172.85 2.14 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.492 177.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.524 ' HG3' ' OE2' ' A' ' 125' ' ' GLU . 7.3 ttmm -127.8 156.8 41.92 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 174.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.524 ' OE2' ' HG3' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -76.31 71.41 3.0 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.505 1.145 . . . . 0.0 111.324 178.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -149.84 17.46 1.09 Allowed Glycine 0 N--CA 1.439 -1.146 0 CA-C-N 112.884 -1.962 . . . . 0.0 108.419 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -137.54 110.48 7.7 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 4.4 m -73.07 -28.95 62.6 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.71 0.632 . . . . 0.0 110.481 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt 62.37 32.89 16.71 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-O 122.42 1.105 . . . . 0.0 108.329 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -93.03 134.96 34.64 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.419 -1.264 . . . . 0.0 109.086 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -176.87 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -176.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -139.83 93.79 2.69 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.357 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -79.79 -53.02 7.19 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.376 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 68.76 177.08 0.26 Allowed 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.991 -175.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -92.19 88.11 6.36 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.721 -175.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 71.42 -53.36 0.68 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.858 1.663 . . . . 0.0 111.705 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.7 t70 64.76 76.62 0.34 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 125.891 1.676 . . . . 0.0 111.11 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.43 -176.66 4.81 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.783 -1.098 . . . . 0.0 111.063 -175.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 79.7 p 68.68 -42.46 0.48 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 127.254 2.222 . . . . 0.0 114.044 177.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.53 -25.64 60.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.172 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.0 t70 . . . . . 0 CA--C 1.499 -1.0 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.09 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 120.109 0.004 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.27 -79.89 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.745 0.307 . . . . 0.0 111.046 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.97 -4.07 18.22 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.241 0.543 . . . . 0.0 110.013 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp -99.99 101.28 11.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.0 mt -113.27 85.1 2.12 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.8 34.22 0.18 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.682 -173.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.414 ' HA ' ' HA2' ' A' ' 51' ' ' GLY . 7.2 t -77.44 -45.47 25.66 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 119.545 -0.862 . . . . 0.0 108.842 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 83.5 mtp 45.46 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.872 1.669 . . . . 0.0 114.879 177.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.487 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 60.4 t30 -99.76 120.22 39.38 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.5 t -110.19 95.03 19.9 Favored Pre-proline 0 C--N 1.307 -1.27 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 5.5 Cg_exo -81.7 -26.07 3.31 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.325 2.016 . . . . 0.0 111.148 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 63.37 -165.43 0.24 Allowed 'General case' 0 C--O 1.253 1.238 0 C-N-CA 124.225 1.01 . . . . 0.0 111.192 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -174.49 111.53 0.37 Allowed Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.48 -54.24 1.83 Allowed 'Trans proline' 0 C--O 1.246 0.918 0 C-N-CA 122.703 2.269 . . . . 0.0 111.415 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.15 -59.99 0.31 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.719 1.608 . . . . 0.0 112.227 -178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.99 -164.01 39.61 Favored Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.78 113.93 2.4 Favored Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 119.919 -1.134 . . . . 0.0 111.975 -178.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 71.98 -74.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.208 1.403 . . . . 0.0 111.844 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -88.38 94.07 9.73 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.807 -0.179 . . . . 0.0 110.958 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.2 t 49.08 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 125.695 1.598 . . . . 0.0 112.12 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.09 101.48 1.84 Allowed 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 119.591 -0.843 . . . . 0.0 109.856 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.456 ' HE1' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.508 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.486 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.52 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.454 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.496 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 7' ' ' THR . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.481 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' HA ' HD13 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 57' ' ' THR . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.455 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.455 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.401 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.409 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.41 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.66 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.41 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.66 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.508 ' CE2' HG23 ' A' ' 34' ' ' ILE . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.409 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.63 -49.11 64.6 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -72.24 -30.95 65.37 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -176.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -87.03 -14.06 42.63 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.303 -0.959 . . . . 0.0 112.609 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -104.83 -57.64 2.0 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.55 63.42 Favored 'General case' 0 CA--C 1.503 -0.833 0 O-C-N 123.361 0.413 . . . . 0.0 111.549 -173.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 52.3 tptt -104.11 99.33 16.48 Favored Pre-proline 0 N--CA 1.428 -1.535 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 174.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.86 92.7 1.03 Allowed 'Trans proline' 0 N--CA 1.436 -1.906 0 C-N-CA 121.752 1.635 . . . . 0.0 113.35 -174.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.91 84.32 7.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.4 121.64 6.2 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 -178.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -124.66 -66.89 0.94 Allowed 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.876 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.54 -78.23 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.804 1.242 . . . . 0.0 109.633 -176.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.61 -96.43 0.29 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -89.65 113.89 25.43 Favored 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 5.7 m -82.23 -52.67 6.74 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.708 -171.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm 58.84 29.02 18.24 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.164 0.586 . . . . 0.0 111.933 -178.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -75.36 161.75 28.99 Favored 'General case' 0 C--O 1.252 1.197 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? 76.92 -65.81 0.27 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.78 1.632 . . . . 0.0 111.107 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -146.14 149.18 33.51 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -86.62 56.99 4.25 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 59.7 -101.09 0.11 Allowed 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.466 1.507 . . . . 0.0 111.913 -173.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -162.6 162.87 27.35 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -179.6 -39.7 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.58 1.175 . . . . 0.0 108.064 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.8 t70 66.66 78.26 0.26 Allowed 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.854 -1.535 . . . . 0.0 106.854 -170.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.8 mtt -80.75 75.97 7.66 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.781 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.6 m -100.48 -46.22 5.29 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.66 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.9 pp -98.86 -18.93 17.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.454 0.645 . . . . 0.0 111.242 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 C--N 1.307 -1.259 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.706 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 N--CA 1.437 -1.088 0 CA-C-O 120.908 0.385 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -99.53 83.04 2.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.016 0.436 . . . . 0.0 111.632 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.44 48.52 21.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.781 0.832 . . . . 0.0 110.203 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mm -74.27 113.97 13.39 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.781 -176.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.72 106.12 12.48 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.11 19.22 15.84 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.42 0.629 . . . . 0.0 111.837 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.8 m -121.96 97.29 5.42 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -83.55 112.18 19.76 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.792 0.806 . . . . 0.0 110.935 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -128.1 127.61 43.37 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -83.11 148.98 57.85 Favored Pre-proline 0 C--N 1.294 -1.82 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -85.75 -171.52 0.91 Allowed 'Trans proline' 0 N--CA 1.444 -1.425 0 C-N-CA 122.438 2.092 . . . . 0.0 111.072 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.94 -175.02 4.88 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.975 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.63 132.08 6.61 Favored Glycine 0 N--CA 1.414 -2.777 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.54 123.85 14.83 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 123.019 2.48 . . . . 0.0 112.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 74.76 129.7 0.04 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 126.086 1.754 . . . . 0.0 112.826 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.17 63.44 4.48 Favored Glycine 0 C--N 1.316 -0.569 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.55 95.14 0.14 Allowed Glycine 0 N--CA 1.431 -1.666 0 N-CA-C 107.449 -2.261 . . . . 0.0 107.449 -175.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -98.65 109.49 22.24 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.273 0.559 . . . . 0.0 111.112 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.77 147.72 24.61 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t 68.55 105.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.208 0 O-C-N 124.063 0.852 . . . . 0.0 109.261 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -70.71 108.97 4.66 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.086 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG21 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.409 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.435 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.551 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.446 ' HB2' ' OE2' ' A' ' 52' ' ' GLU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.446 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.448 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.504 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.504 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.551 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.47 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.47 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.41 ' HB2' HD12 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.564 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 118' ' ' ASN . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 94.7 mmm -67.45 -50.47 59.1 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.259 0.8 OUTLIER -72.47 -32.05 65.92 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -176.615 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -82.24 -24.85 34.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 114' ' ' ALA . 12.4 m-80 -95.36 -54.03 3.55 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.4 -76.01 0.08 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.097 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.8 pttm 36.57 77.95 0.37 Allowed Pre-proline 0 CA--C 1.558 1.252 0 C-N-CA 124.589 1.156 . . . . 0.0 112.079 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.78 -36.71 63.43 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.734 2.956 . . . . 0.0 114.67 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.51 -29.86 68.55 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.95 56.33 1.95 Allowed 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.571 1.177 . . . . 0.0 109.335 -175.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -143.65 83.18 1.75 Allowed 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 104.156 -2.535 . . . . 0.0 104.156 169.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.81 -23.94 25.18 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.102 -1.863 . . . . 0.0 112.483 -168.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.87 3.41 Favored Glycine 0 N--CA 1.432 -1.592 0 C-N-CA 119.641 -1.266 . . . . 0.0 112.702 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -96.7 -79.85 0.44 Allowed 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 23.6 m 57.91 -66.69 0.03 OUTLIER 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.858 1.663 . . . . 0.0 114.013 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm 58.87 27.59 16.36 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.377 1.471 . . . . 0.0 112.266 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -154.86 107.26 2.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.123 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -103.47 -31.82 9.79 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.078 178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 9.0 tptm 56.39 -171.22 0.08 Allowed 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.032 1.333 . . . . 0.0 110.686 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.0 -43.53 0.06 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 77.57 125.13 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.716 1.206 . . . . 0.0 113.984 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.99 116.41 32.64 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -137.05 0.33 2.36 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 62.9 t0 51.35 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.584 1.153 . . . . 0.0 110.692 -169.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 27.6 ttt -72.6 -15.79 61.74 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.811 -175.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 m -101.43 6.05 42.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.739 -178.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 5.6 tt -64.97 -52.61 55.29 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.195 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.8 m120 69.63 159.8 0.19 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 175.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.66 88.66 2.15 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.05 92.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-O 121.79 0.805 . . . . 0.0 110.114 -173.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 tt 171.38 -32.63 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 103.113 -2.921 . . . . 0.0 103.113 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 73.4 -79.24 0.04 OUTLIER 'General case' 0 C--N 1.349 0.571 0 CA-C-N 113.364 -1.744 . . . . 0.0 111.336 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -150.13 125.0 9.85 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -83.96 -39.9 19.16 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.583 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 10.3 t30 69.35 159.25 0.18 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.915 175.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -97.25 92.19 1.16 Allowed Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 121.724 0.773 . . . . 0.0 109.168 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 2.0 Cg_endo -82.65 -60.05 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.273 1.982 . . . . 0.0 115.008 -173.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 66.65 26.31 9.71 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.969 0.908 . . . . 0.0 108.919 -170.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.88 125.27 8.18 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.938 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -102.65 19.81 0.19 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.875 2.384 . . . . 0.0 111.829 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.2 -175.82 0.2 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.512 1.125 . . . . 0.0 110.616 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -169.29 174.37 43.7 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.07 75.81 0.06 OUTLIER Glycine 0 C--N 1.306 -1.086 0 C-N-CA 120.703 -0.761 . . . . 0.0 111.366 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -88.21 146.46 25.35 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.84 -41.32 0.5 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.684 1.594 . . . . 0.0 113.754 173.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 t -93.49 127.59 45.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -86.77 96.82 10.31 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.443 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.447 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.41 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.486 ' O ' HD12 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.404 ' HB3' HD12 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.486 HD12 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.543 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.404 HD12 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.412 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.412 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.425 ' CZ ' HD23 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD23 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.543 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.404 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.434 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.625 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.434 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.625 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.43 ' HB2' HD12 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.43 HD12 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG13 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.409 HG13 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.404 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.432 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.432 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm -60.92 -57.8 11.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.259 0.7 OUTLIER -71.54 -16.9 62.34 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -176.356 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -78.5 -41.81 31.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.303 175.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -79.99 -43.48 21.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.921 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.99 66.84 7.75 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.211 1.005 . . . . 0.0 108.339 173.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -59.39 131.48 87.89 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 113.228 -1.805 . . . . 0.0 109.37 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.51 76.82 0.52 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.645 2.23 . . . . 0.0 112.714 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 179.23 -39.57 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 127.197 2.199 . . . . 0.0 106.189 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 50.0 86.1 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.166 1.787 . . . . 0.0 112.674 176.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -151.63 119.78 6.3 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.451 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -103.03 136.39 42.94 Favored 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.361 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.88 77.75 1.09 Allowed Glycine 0 N--CA 1.432 -1.585 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.112 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -100.75 111.51 23.74 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 13.2 t -91.9 144.38 25.54 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.061 0.458 . . . . 0.0 110.987 -174.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -79.18 105.44 10.51 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.306 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.429 ' OD2' ' HB2' ' A' ' 132' ' ' LYS . 34.1 t70 -111.05 124.74 52.78 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.781 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.564 ' HD2' ' N ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -76.92 -35.35 57.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.772 0.32 . . . . 0.0 111.656 -179.484 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . 0.564 ' N ' ' HD2' ' A' ' 131' ' ' LYS . 17.2 ttmm 59.43 -83.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.289 1.435 . . . . 0.0 114.239 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 134' ' ' GLU . 6.7 p-10 -85.71 -95.36 0.08 Allowed 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 123.679 0.792 . . . . 0.0 111.987 -173.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . 0.452 ' H ' ' CG ' ' A' ' 133' ' ' ASP . 36.9 mt-10 -99.84 136.67 39.41 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -103.86 116.01 31.5 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.618 0.723 . . . . 0.0 111.219 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -122.65 130.01 52.49 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.332 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -87.51 151.64 22.85 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.78 -30.51 67.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.124 0.488 . . . . 0.0 111.109 178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.8 m -96.93 9.95 40.51 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.15 -0.344 . . . . 0.0 111.546 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 60.4 tp -84.28 -53.99 5.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.024 0.44 . . . . 0.0 110.305 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.597 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -144.29 153.3 41.87 Favored 'General case' 0 CA--C 1.502 -0.896 0 O-C-N 122.071 -0.393 . . . . 0.0 111.065 -176.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.18 79.94 1.8 Allowed 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.2 mt -81.67 79.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 122.085 0.945 . . . . 0.0 109.944 -174.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.0 mt -104.16 84.16 2.19 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.654 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.7 72.98 0.18 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.86 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.9 t -81.38 -24.41 37.02 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -142.98 140.06 30.9 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -86.4 73.85 10.06 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.279 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.2 m -111.76 122.83 36.14 Favored Pre-proline 0 N--CA 1.424 -1.774 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.688 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.79 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.183 1.922 . . . . 0.0 111.73 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.52 141.06 23.39 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.25 80.83 0.32 Allowed Glycine 0 C--N 1.289 -2.05 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.598 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -91.21 16.19 1.61 Allowed 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 122.545 2.163 . . . . 0.0 111.407 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.6 -66.02 0.28 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.428 1.491 . . . . 0.0 112.704 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.63 -127.64 5.87 Favored Glycine 0 N--CA 1.432 -1.631 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -119.28 133.48 10.15 Favored Glycine 0 C--N 1.302 -1.353 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -88.65 -23.97 22.9 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.033 0.444 . . . . 0.0 111.314 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -89.81 -72.58 0.55 Allowed 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.2 t -117.12 111.05 33.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.459 ' O ' HG11 ' A' ' 25' ' ' VAL . 25.0 t70 -76.42 116.57 17.23 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.713 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.459 HG11 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.6 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.6 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.477 HG22 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.564 ' SD ' HD11 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.507 ' O ' HG21 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.468 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.418 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.439 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.424 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.467 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.465 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.795 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.795 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.1 p30 -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.46 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.46 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.451 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.564 HD11 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.439 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.482 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.482 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.456 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.477 ' SD ' HG22 ' A' ' 30' ' ' ILE . 48.2 ttm -66.08 -59.43 3.8 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.261 3.7 pp0? -72.06 -24.71 61.56 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 119.168 -1.013 . . . . 0.0 112.867 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -70.24 -42.5 72.13 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.257 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -104.93 -27.29 11.79 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -173.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.73 65.56 7.92 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -172.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.74 125.07 0.27 Allowed Pre-proline 0 C--N 1.307 -1.267 0 C-N-CA 125.418 1.487 . . . . 0.0 107.805 170.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -92.48 7.74 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.446 2.098 . . . . 0.0 112.096 -177.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -82.73 -8.86 59.56 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -174.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.5 tm0? -66.45 120.81 14.0 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -148.17 168.24 22.97 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.058 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -166.98 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.08 25.68 12.46 Favored Glycine 0 N--CA 1.441 -1.004 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.043 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -88.28 96.61 10.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.559 0.695 . . . . 0.0 109.39 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 5.0 m -118.0 -13.7 10.01 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.377 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.51 ' C ' ' H ' ' A' ' 131' ' ' LYS . 3.6 mptp? 63.04 35.69 12.9 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.703 0.763 . . . . 0.0 110.025 -174.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -79.85 27.59 0.3 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.565 1.146 . . . . 0.0 110.063 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.51 ' H ' ' C ' ' A' ' 129' ' ' LYS . 38.0 ttpt -87.74 129.14 35.26 Favored 'General case' 0 N--CA 1.423 -1.795 0 CA-C-N 114.209 -1.36 . . . . 0.0 109.265 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -137.68 140.34 40.74 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 63.59 -115.19 0.44 Allowed 'General case' 0 C--O 1.243 0.732 0 O-C-N 123.801 0.688 . . . . 0.0 109.319 -177.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 66.68 -65.79 0.2 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.166 1.386 . . . . 0.0 112.663 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 41.8 tt0 -166.94 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -172.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 135' ' ' GLU . 12.7 pt-20 63.9 -0.12 0.85 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 127.541 2.336 . . . . 0.0 114.47 174.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 27.1 t70 61.65 92.77 0.05 Allowed 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.823 1.249 . . . . 0.0 111.342 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.6 ttt -104.13 89.68 3.35 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.569 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -62.22 -39.49 92.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.571 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -144.63 -63.17 0.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.6 t70 . . . . . 0 C--N 1.307 -1.272 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.642 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.452 ' HB3' ' HB1' ' A' ' 38' ' ' ALA . 31.0 p-10 -71.23 111.15 6.34 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.816 1.293 . . . . 0.0 113.441 -177.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.34 34.13 1.07 Allowed 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 173.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.1 mt -49.19 119.26 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.049 -170.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.7 mt -86.97 139.93 30.1 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.789 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.49 92.3 9.04 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 105.912 -1.884 . . . . 0.0 105.912 171.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -66.3 -30.22 70.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.774 0.797 . . . . 0.0 109.534 -175.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.43 145.95 2.73 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 172.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.51 ' OD1' ' HA ' ' A' ' 50' ' ' SER . 18.4 t-20 -134.87 72.08 1.45 Allowed 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 118.636 -1.226 . . . . 0.0 111.642 -178.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 42.3 t -138.95 71.68 41.45 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -96.19 -18.01 0.3 Allowed 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.992 1.794 . . . . 0.0 114.107 -177.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.59 72.57 0.51 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.06 0.944 . . . . 0.0 110.574 -171.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -105.1 105.59 2.54 Favored Glycine 0 N--CA 1.429 -1.782 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.664 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -95.67 168.64 1.34 Allowed 'Trans proline' 0 N--CA 1.437 -1.8 0 C-N-CA 122.751 2.301 . . . . 0.0 112.008 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.14 91.33 5.22 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.86 -53.83 40.1 Favored Glycine 0 CA--C 1.504 -0.627 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.339 -178.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.72 125.55 8.19 Favored Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -156.82 102.27 2.01 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.428 0.633 . . . . 0.0 110.464 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.426 ' O ' ' HB ' ' A' ' 20' ' ' VAL . 8.7 tt0 -145.55 144.94 30.81 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 176.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.426 ' HB ' ' O ' ' A' ' 19' ' ' GLN . 77.6 t 73.61 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 O-C-N 124.469 1.106 . . . . 0.0 109.43 -172.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG13 ' A' ' 25' ' ' VAL . 38.1 t70 -76.49 94.14 3.65 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.279 -0.888 . . . . 0.0 109.082 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.416 HG12 ' HG ' ' A' ' 26' ' ' LEU . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.416 ' HG ' HG12 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.41 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.432 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.452 ' HB1' ' HB3' ' A' ' 2' ' ' ASN . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.406 HG21 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.635 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.635 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.689 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.51 ' HA ' ' OD1' ' A' ' 9' ' ' ASN . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.426 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.689 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.479 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.528 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.479 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . 0.425 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.425 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.41 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm -61.22 -55.06 36.42 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.408 ' HG2' HG22 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.85 -30.28 68.77 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -176.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -74.91 -34.92 62.23 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.923 0.392 . . . . 0.0 111.897 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -96.85 -56.2 2.64 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -173.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -169.93 108.31 0.38 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -171.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -127.58 85.78 60.02 Favored Pre-proline 0 C--N 1.302 -1.48 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -103.05 25.85 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 123.128 2.552 . . . . 0.0 113.261 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -73.13 -47.08 47.19 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -172.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.458 HE22 ' HB2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -91.91 107.12 18.98 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.153 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -116.1 81.18 1.56 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.204 0.526 . . . . 0.0 111.976 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.458 ' HB2' HE22 ' A' ' 123' ' ' GLN . 0.2 OUTLIER -145.02 97.45 3.02 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 174.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 153.74 40.93 0.02 OUTLIER Glycine 0 C--N 1.283 -2.37 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -64.15 110.55 2.22 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.17 -1.015 . . . . 0.0 109.702 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 10.4 m -117.73 97.98 6.13 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.265 0.555 . . . . 0.0 110.252 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.47 -9.81 46.04 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.655 0.741 . . . . 0.0 109.692 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -89.54 129.77 35.96 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.668 -174.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -95.77 -53.51 3.67 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.213 -175.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -148.38 138.49 22.5 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -95.44 139.98 30.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -99.35 15.3 26.73 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.913 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -80.69 -36.08 32.77 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.51 109.22 7.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 172.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.0 133.03 39.22 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.5 ptm -129.62 25.61 5.37 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.3 m -83.27 -53.74 5.53 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -107.95 74.07 0.93 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-O 121.993 0.902 . . . . 0.0 108.975 175.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.304 -1.38 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.53 -177.99 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -103.08 -165.11 1.14 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 81.46 34.52 0.1 Allowed 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.536 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.3 mp -85.44 81.57 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 174.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -104.71 117.28 33.69 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.013 -172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.9 86.37 2.23 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 9' ' ' ASN . 15.1 t -108.8 -28.82 8.98 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.483 -174.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.6 ptt? 54.33 24.17 4.91 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.269 1.428 . . . . 0.0 113.243 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.458 ' H ' HG21 ' A' ' 7' ' ' THR . 78.0 m-20 -84.37 111.62 19.6 Favored 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.742 178.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -152.16 95.15 3.19 Favored Pre-proline 0 C--N 1.292 -1.929 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -95.83 -174.32 0.28 Allowed 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.423 2.082 . . . . 0.0 112.017 -178.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.15 76.43 4.63 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 175.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.62 118.3 4.97 Favored Glycine 0 N--CA 1.425 -2.067 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.347 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -76.6 93.69 1.05 Allowed 'Trans proline' 0 N--CA 1.444 -1.411 0 C-N-CA 122.234 1.956 . . . . 0.0 110.156 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.51 174.03 11.29 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.75 33.13 0.88 Allowed Glycine 0 C--N 1.3 -1.467 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -176.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.59 28.94 3.55 Favored Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.892 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -141.59 158.09 44.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 117.187 0.494 . . . . 0.0 110.058 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 62.64 30.77 16.96 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.983 1.313 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.5 t 60.27 80.11 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -171.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG13 ' A' ' 25' ' ' VAL . 11.9 t70 -67.05 97.61 0.52 Allowed 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.128 -174.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB3' ' NE2' ' A' ' 62' ' ' GLN . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG23 ' A' ' 40' ' ' VAL . 30.1 t30 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.413 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.769 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.4 mm-40 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.769 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 9.2 p30 -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.477 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.494 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.451 ' HA2' ' CB ' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.494 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.449 ' CE1' ' HA ' ' A' ' 34' ' ' ILE . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.408 HD12 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.492 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.451 ' CB ' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.518 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp -75.63 -45.63 36.22 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.32 3.1 pp0? -82.96 -7.42 59.67 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -179.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -98.0 -12.49 21.89 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.772 173.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -123.29 -57.52 1.67 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.3 -38.72 68.65 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -172.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 8.8 ptpt -136.45 80.51 38.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-O 121.038 0.447 . . . . 0.0 111.559 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -81.85 -0.7 10.5 Favored 'Trans proline' 0 C--O 1.253 1.256 0 C-N-CA 122.587 2.192 . . . . 0.0 111.614 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 64.4 -168.28 0.21 Allowed 'General case' 0 C--O 1.254 1.305 0 C-N-CA 124.654 1.181 . . . . 0.0 110.065 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -83.14 84.84 7.33 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 119.756 -0.777 . . . . 0.0 108.997 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -84.43 39.3 0.72 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.214 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -93.0 -17.7 23.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.844 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.22 46.95 3.44 Favored Glycine 0 C--O 1.243 0.704 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -164.99 140.14 5.29 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t -118.0 149.77 40.39 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -68.54 -53.86 20.39 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 106.185 -1.783 . . . . 0.0 106.185 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.3 p30 172.8 -179.21 0.08 Allowed 'General case' 0 CA--C 1.499 -1.005 0 C-N-CA 126.641 1.976 . . . . 0.0 107.868 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -143.66 172.91 12.16 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.234 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -78.24 123.41 26.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.427 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -141.55 106.65 4.96 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 123.623 0.577 . . . . 0.0 109.622 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -139.29 104.21 4.93 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.803 0.811 . . . . 0.0 110.84 177.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -115.95 -67.67 0.98 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -108.59 -59.93 1.81 Allowed 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 173.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.9 t70 62.4 11.71 4.8 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 125.053 1.341 . . . . 0.0 113.277 169.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . 0.296 23.8 ptt? 48.76 -167.45 0.02 OUTLIER 'General case' 0 C--O 1.245 0.857 0 C-N-CA 124.989 1.316 . . . . 0.0 113.499 -174.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m 70.75 16.55 6.71 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.561 0.744 . . . . 0.0 111.462 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -109.73 -37.51 5.64 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--N 1.308 -1.203 0 C-N-CA 126.314 1.846 . . . . 0.0 106.995 173.986 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.437 -1.092 0 CA-C-O 121.155 0.502 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -121.8 114.95 21.79 Favored 'General case' 0 CA--C 1.483 -1.605 0 CA-C-O 120.811 0.339 . . . . 0.0 110.231 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.15 94.41 4.08 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 173.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.2 mm -97.66 126.05 50.67 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.839 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 tt -82.52 95.4 7.72 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.05 121.11 43.47 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.2 m 70.24 99.84 0.06 Allowed 'General case' 0 C--N 1.314 -0.954 0 O-C-N 124.413 1.071 . . . . 0.0 112.378 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -93.48 22.62 5.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.937 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 77.17 146.26 0.09 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.936 1.694 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t 67.44 80.32 0.22 Allowed Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.442 1.097 . . . . 0.0 111.717 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.34 -31.63 27.87 Favored 'Trans proline' 0 C--O 1.249 1.064 0 C-N-CA 122.43 2.087 . . . . 0.0 110.916 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 73.67 141.26 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.711 1.604 . . . . 0.0 112.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.05 77.68 1.13 Allowed Glycine 0 N--CA 1.437 -1.26 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.563 -178.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.2 -34.44 36.33 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.875 2.383 . . . . 0.0 113.746 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.7 -48.66 1.52 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 120.999 0.428 . . . . 0.0 110.8 -178.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 143.62 -96.02 0.19 Allowed Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 67.56 36.93 89.1 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 178.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -94.07 110.25 21.96 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -76.2 -55.28 5.72 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 173.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t -95.1 75.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.42 -1.939 0 CA-C-O 122.214 1.006 . . . . 0.0 109.055 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -85.75 109.11 18.41 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 175.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.422 ' HB1' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.482 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.571 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.476 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.422 ' NE2' ' HB1' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.422 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.433 ' HG ' ' HE1' ' A' ' 90' ' ' MET . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.692 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.433 ' HE1' ' HG ' ' A' ' 86' ' ' LEU . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.692 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.46 ' HB2' HD12 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.46 HD12 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.567 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . 0.452 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.567 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.94 -58.76 6.24 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.265 4.1 pp0? -70.12 -16.39 63.11 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -80.16 -24.29 40.51 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -128.79 16.68 6.33 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.697 -175.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.24 -48.17 58.12 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.048 0.451 . . . . 0.0 110.853 -177.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -114.89 97.96 48.87 Favored Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -93.29 21.91 0.61 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.53 2.153 . . . . 0.0 111.737 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -104.52 119.58 39.3 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.739 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.47 -35.06 11.27 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.549 172.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 61.97 18.93 10.33 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.039 1.336 . . . . 0.0 111.087 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -102.69 -27.29 12.8 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 100.5 -150.76 18.91 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -155.41 103.86 2.35 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.38 0.59 . . . . 0.0 111.133 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 95.0 m -90.29 126.66 35.92 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.425 ' N ' ' HD2' ' A' ' 129' ' ' LYS . 3.7 mptp? -73.71 -63.73 1.14 Allowed 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.81 -177.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -117.32 -88.21 0.6 Allowed 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.571 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -156.63 170.58 22.08 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 14.81 2.28 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 124.013 0.82 . . . . 0.0 109.755 174.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -108.3 141.32 40.26 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.47 135.25 38.24 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.111 0.481 . . . . 0.0 110.85 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -107.3 -179.38 3.91 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.84 -22.13 37.17 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.337 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.4 t70 55.99 67.61 0.98 Allowed 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.154 -177.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 88.3 mtp 65.43 -78.11 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 113.605 -1.634 . . . . 0.0 112.321 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 12.4 p 51.13 35.43 13.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.519 1.152 . . . . 0.0 111.021 -174.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -106.66 -54.36 2.48 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 113.954 -1.475 . . . . 0.0 108.388 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.841 -178.518 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -90.14 131.18 36.12 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 120.926 0.393 . . . . 0.0 110.688 -177.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.4 93.91 2.44 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.076 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.12 92.36 2.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 177.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -93.86 127.13 39.45 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.33 105.39 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.0 m -91.35 45.51 1.24 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.853 1.311 . . . . 0.0 111.0 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -162.76 95.11 0.88 Allowed 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.751 -3.055 . . . . 0.0 102.751 173.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -150.16 177.35 9.99 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.486 -171.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -112.62 101.2 52.32 Favored Pre-proline 0 N--CA 1.433 -1.283 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -55.94 -40.8 82.86 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.947 2.431 . . . . 0.0 112.854 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.09 60.51 3.4 Favored 'General case' 0 C--O 1.247 0.935 0 O-C-N 124.261 0.976 . . . . 0.0 109.669 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . 0.428 ' C ' ' H ' ' A' ' 15' ' ' ALA . . . -82.31 136.09 15.09 Favored Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.953 -178.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -68.38 27.83 0.14 Allowed 'Trans proline' 0 CA--C 1.554 1.491 0 C-N-CA 124.046 3.164 . . . . 0.0 114.266 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.43 ' HB2' HE22 ' A' ' 71' ' ' GLN . . . -73.49 153.19 40.43 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.357 0.663 . . . . 0.0 109.344 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 158.87 -160.29 31.0 Favored Glycine 0 N--CA 1.426 -2.009 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.396 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.25 51.55 4.51 Favored Glycine 0 C--N 1.31 -0.891 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -89.8 130.0 36.11 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.96 -37.88 58.14 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 119.57 -0.852 . . . . 0.0 109.171 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.06 73.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 172.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.484 ' O ' HG11 ' A' ' 25' ' ' VAL . 17.2 t70 -83.7 109.19 17.28 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.213 -1.358 . . . . 0.0 107.806 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.484 HG11 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' THR . . . . . 0.403 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.403 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.452 ' HE3' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.522 ' O ' HG21 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.522 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.598 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.473 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.473 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.468 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.468 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.43 HE22 ' HB2' ' A' ' 15' ' ' ALA . 99.3 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.598 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.487 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.487 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.474 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . 0.54 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm -63.53 -54.72 31.83 Favored 'General case' 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.54 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.333 3.0 pp0? -76.8 -8.93 58.25 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 118.525 -1.27 . . . . 0.0 114.254 179.323 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.87 -19.72 47.61 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.596 174.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -130.88 -45.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -100.29 15.13 28.65 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.419 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 63.0 tttm -87.09 116.1 64.93 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 176.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 120' ' ' LYS . 2.7 Cg_exo -73.77 75.91 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.522 2.148 . . . . 0.0 113.007 -174.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -91.11 98.54 11.81 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.945 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 65.59 -73.63 0.06 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.643 1.577 . . . . 0.0 112.13 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . 0.37 32.2 mttp 47.84 65.43 1.3 Allowed 'General case' 0 CA--C 1.493 -1.25 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.91 71.57 0.42 Allowed 'General case' 0 N--CA 1.421 -1.912 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 175.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -137.62 73.88 0.42 Allowed Glycine 0 N--CA 1.42 -2.372 0 N-CA-C 107.303 -2.319 . . . . 0.0 107.303 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -78.55 178.89 7.43 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 114.557 -0.821 . . . . 0.0 109.369 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -97.13 111.79 23.87 Favored 'General case' 0 N--CA 1.427 -1.58 0 O-C-N 121.792 -0.567 . . . . 0.0 110.92 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.403 ' HD3' ' N ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -123.24 83.36 2.12 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 122.031 0.92 . . . . 0.0 110.028 176.286 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -93.12 -23.24 18.67 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.475 -1.238 . . . . 0.0 111.005 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -84.58 111.5 19.58 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -138.06 178.09 7.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -66.5 -30.87 71.3 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 170.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -81.38 90.72 6.19 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -117.89 -54.15 2.35 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.795 -175.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -102.88 145.95 29.04 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -100.56 124.33 45.98 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 13.9 tpt -78.63 80.46 5.0 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.904 0.859 . . . . 0.0 110.107 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 2.1 m -77.45 -29.66 52.9 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.823 -178.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.3 mp -58.98 -53.44 58.41 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.965 -177.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 CA--C 1.487 -1.461 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.821 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.243 0.719 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -121.12 141.69 50.56 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.2 97.02 6.88 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 pt -115.68 -11.42 11.97 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.94 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt 69.58 -64.87 0.33 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.053 1.341 . . . . 0.0 110.141 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 174.4 -33.05 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 127.05 2.14 . . . . 0.0 105.558 -177.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 m 72.82 -56.12 0.66 Allowed 'General case' 0 C--N 1.351 0.673 0 CA-C-N 113.749 -1.569 . . . . 0.0 111.567 176.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.533 ' SD ' ' HG3' ' A' ' 46' ' ' PRO . 20.4 ptm -130.87 103.19 6.42 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 121.6 0.714 . . . . 0.0 110.398 -178.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -80.69 104.83 11.48 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.163 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -138.29 134.99 17.93 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.696 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -66.2 -45.89 5.06 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 121.98 1.787 . . . . 0.0 109.157 170.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.44 -167.05 0.13 Allowed 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.947 1.299 . . . . 0.0 112.902 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -139.57 76.57 0.33 Allowed Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 174.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.8 -46.66 10.49 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.062 2.508 . . . . 0.0 114.198 -177.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 122.22 22.06 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.867 0.365 . . . . 0.0 110.775 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.3 110.78 0.46 Allowed Glycine 0 N--CA 1.429 -1.816 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.87 -114.52 5.35 Favored Glycine 0 C--N 1.312 -0.785 0 C-N-CA 121.073 -0.584 . . . . 0.0 112.006 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 70.58 103.23 0.06 Allowed 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.41 1.484 . . . . 0.0 113.24 178.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -108.53 159.07 16.99 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 175.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.5 t 69.47 125.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 124.334 1.021 . . . . 0.0 110.848 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -70.55 104.35 2.76 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.498 HD13 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' N ' HD13 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.412 HG21 ' HG2' ' A' ' 116' ' ' GLN . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.508 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.478 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.508 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.533 ' HG3' ' SD ' ' A' ' 8' ' ' MET . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.425 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.447 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.585 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.585 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.447 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.425 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.443 ' HG ' ' HE3' ' A' ' 90' ' ' MET . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.654 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.443 ' HE3' ' HG ' ' A' ' 86' ' ' LEU . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.654 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.404 ' HG3' ' HB2' ' A' ' 118' ' ' ASN . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.536 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm -69.51 -40.42 76.97 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.412 ' HG2' HG21 ' A' ' 25' ' ' VAL 0.257 0.8 OUTLIER -74.24 -22.73 59.21 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.398 -0.921 . . . . 0.0 113.055 179.617 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -83.94 -39.06 20.24 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.863 0.363 . . . . 0.0 111.577 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.404 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . 46.6 m-80 -99.04 -46.72 5.49 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.93 7.62 17.66 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.423 0.63 . . . . 0.0 111.778 -172.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -111.76 92.76 18.16 Favored Pre-proline 0 C--N 1.293 -1.873 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.89 -43.89 14.73 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 122.784 2.323 . . . . 0.0 114.083 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 68.21 171.27 0.28 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.359 1.064 . . . . 0.0 111.992 -177.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -146.54 -56.7 0.27 Allowed 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.25 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt 40.25 74.96 0.09 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.45 1.5 . . . . 0.0 114.582 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.09 0.12 29.27 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.241 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -73.82 57.85 2.18 Favored Glycine 0 N--CA 1.464 0.525 0 CA-C-O 121.698 0.61 . . . . 0.0 111.681 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -141.65 -65.75 0.42 Allowed 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -177.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' THR . . . . . 0.442 HG22 ' H ' ' A' ' 130' ' ' ASP . 9.1 m 67.96 149.58 0.06 Allowed 'General case' 0 CA--C 1.571 1.755 0 C-N-CA 124.234 1.014 . . . . 0.0 112.458 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -70.27 -23.24 62.85 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.738 0.78 . . . . 0.0 109.938 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . 0.442 ' H ' HG22 ' A' ' 128' ' ' THR . 9.5 m-20 -78.93 140.44 38.06 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.221 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 50.8 tptt 68.87 31.06 4.46 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 124.708 1.255 . . . . 0.0 108.576 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -124.49 -53.58 1.69 Allowed 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.15 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -97.43 -73.41 0.61 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -172.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -82.93 102.26 11.58 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -166.16 82.81 0.29 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -93.56 110.38 21.98 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.31 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -126.12 132.26 51.9 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 67.2 mtt -93.72 -42.19 9.28 Favored 'General case' 0 C--N 1.286 -2.186 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.579 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 50.4 m 53.23 40.35 31.13 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.931 0.769 . . . . 0.0 111.022 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 67.51 89.02 0.1 Allowed 'General case' 0 C--O 1.249 1.034 0 C-N-CA 124.526 1.131 . . . . 0.0 110.398 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.301 -1.509 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.286 -178.077 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -102.01 85.63 2.72 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.45 85.03 6.79 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -169.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.2 mp -108.84 -68.03 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 168.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.506 ' O ' HD11 ' A' ' 5' ' ' LEU . 2.9 tm? -117.43 -14.52 10.34 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.53 128.81 39.05 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.8 t -137.56 -170.55 2.78 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -82.34 -17.28 46.24 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 120.699 0.285 . . . . 0.0 111.101 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -116.55 156.29 27.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.134 0.492 . . . . 0.0 111.412 -174.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.6 t -137.84 122.37 12.07 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -64.18 -45.79 9.24 Favored 'Trans proline' 0 C--O 1.25 1.123 0 C-N-CA 122.588 2.192 . . . . 0.0 112.001 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.72 -162.59 0.27 Allowed 'General case' 0 C--O 1.249 1.038 0 O-C-N 124.054 0.846 . . . . 0.0 109.846 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.18 -166.67 38.9 Favored Glycine 0 N--CA 1.425 -2.052 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 178.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.62 139.32 82.77 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 123.181 2.587 . . . . 0.0 111.26 178.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.78 109.2 2.79 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.529 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.52 54.07 4.89 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -108.93 124.3 7.3 Favored Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.62 161.03 35.74 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -177.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -61.59 -43.32 99.07 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 111.176 -176.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.54 80.62 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 173.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG11 ' A' ' 25' ' ' VAL . 21.5 t70 -56.85 119.79 6.82 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.49 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' MET . . . . . 0.407 ' HB3' HD12 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.512 ' O ' HG21 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.634 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.634 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.548 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.452 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.443 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.452 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.47 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.47 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.548 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.412 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.503 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.503 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm -67.73 -55.45 13.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . 0.482 ' O ' ' HB2' ' A' ' 120' ' ' LYS 0.309 0.1 OUTLIER -71.93 -19.26 61.94 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.443 1.645 . . . . 0.0 115.443 -176.395 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.8 p30 -86.46 -32.65 20.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 119.884 -0.726 . . . . 0.0 112.33 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -85.89 -48.05 9.09 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.99 0.424 . . . . 0.0 110.843 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.85 66.29 9.54 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 116' ' ' GLN . 65.8 tttm -139.64 89.21 11.88 Favored Pre-proline 0 N--CA 1.424 -1.756 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.844 -174.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -71.91 -23.09 22.46 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.116 1.878 . . . . 0.0 109.87 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 120' ' ' LYS . 45.3 mt-10 -66.93 127.97 34.55 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.541 176.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -79.67 178.44 8.16 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.104 0.478 . . . . 0.0 110.73 -176.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.406 ' HZ2' ' HB2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -107.62 154.0 22.07 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.402 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -135.86 -54.35 0.77 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -171.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -147.03 46.8 0.71 Allowed Glycine 0 CA--C 1.473 -2.576 0 N-CA-C 108.846 -1.702 . . . . 0.0 108.846 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -130.39 125.49 34.68 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 114.289 -0.956 . . . . 0.0 110.699 -173.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 42.2 m -73.8 -55.6 6.02 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 79.8 tttt 57.03 27.51 13.41 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 122.238 1.018 . . . . 0.0 110.783 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -169.48 -164.09 0.43 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 103.957 -2.609 . . . . 0.0 103.957 -175.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -102.55 169.13 8.85 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -86.11 123.22 31.16 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 119.325 -0.95 . . . . 0.0 112.251 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.46 70.57 1.41 Allowed 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.862 -1.532 . . . . 0.0 106.862 172.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -153.17 175.44 13.04 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.313 -171.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 80.04 106.63 0.07 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 71.47 -46.76 0.65 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 166.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 67.77 31.91 5.62 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.142 0.977 . . . . 0.0 110.819 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.4 tpt 70.42 -41.62 0.5 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.137 1.375 . . . . 0.0 114.381 175.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m 72.9 -48.45 0.69 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.059 1.344 . . . . 0.0 112.249 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.27 25.47 1.38 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.999 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 176.773 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -142.51 92.54 2.43 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.48 135.03 12.53 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.131 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -97.66 84.16 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.8 tp -71.52 -23.5 61.79 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.461 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.27 68.51 0.67 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 124.051 0.941 . . . . 0.0 109.933 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.1 m -90.16 149.81 22.28 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.5 mpp? 68.92 93.18 0.08 Allowed 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 123.935 0.772 . . . . 0.0 108.922 -172.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -113.41 116.45 29.65 Favored 'General case' 0 C--N 1.292 -1.895 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.29 128.21 92.96 Favored Pre-proline 0 C--N 1.315 -0.919 0 O-C-N 123.433 0.458 . . . . 0.0 110.285 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.78 -28.89 5.96 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 121.984 1.789 . . . . 0.0 111.199 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.1 -163.42 0.26 Allowed 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.134 0.974 . . . . 0.0 109.951 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -124.08 75.9 0.38 Allowed Glycine 0 C--N 1.296 -1.694 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -88.75 79.72 1.01 Allowed 'Trans proline' 0 N--CA 1.432 -2.123 0 C-N-CA 122.361 2.041 . . . . 0.0 111.525 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.61 82.4 6.35 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.46 -56.36 3.5 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -176.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 116.64 -44.28 1.49 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 178.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -168.85 -77.18 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -170.44 -67.52 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.31 75.7 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 170.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.531 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 -85.11 128.33 34.61 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.289 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.531 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.412 ' HG ' HG11 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.503 ' O ' HG21 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.47 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.548 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.545 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.458 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.476 ' HB3' ' NE2' ' A' ' 85' ' ' GLN . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.476 ' NE2' ' HB3' ' A' ' 83' ' ' SER . 1.3 mp0 -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.419 ' HG ' ' HE2' ' A' ' 90' ' ' MET . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.541 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.419 ' HE2' ' HG ' ' A' ' 86' ' ' LEU . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.441 ' HB2' HD12 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.431 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.458 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.596 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' MET . . . . . 0.596 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.41 -56.12 21.26 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.12 -28.03 64.0 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -67.31 -47.86 69.32 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 120.958 0.409 . . . . 0.0 111.647 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -82.51 -35.25 27.53 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.166 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.36 36.13 27.01 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.377 1.071 . . . . 0.0 111.1 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' LYS . . . . . 0.595 ' O ' ' HD2' ' A' ' 120' ' ' LYS 0.356 0.1 OUTLIER 53.4 93.79 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 125.054 1.342 . . . . 0.0 112.819 -175.082 . . . . . . . . 4 4 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.29 -31.11 88.98 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.756 2.304 . . . . 0.0 112.946 -176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 57.95 -81.54 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.393 1.077 . . . . 0.0 110.714 -172.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.85 100.01 6.97 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 121.672 0.749 . . . . 0.0 109.324 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 50.8 mttp -139.98 43.88 1.93 Allowed 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 169.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -83.77 14.74 3.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 112.037 -2.347 . . . . 0.0 110.092 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.77 -31.03 2.89 Favored Glycine 0 C--N 1.3 -1.469 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.8 t70 70.66 112.29 0.05 Allowed 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 125.564 1.545 . . . . 0.0 112.631 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 39.4 m -80.19 88.83 5.45 Favored 'General case' 0 N--CA 1.416 -2.157 0 CA-C-O 121.695 0.76 . . . . 0.0 110.068 178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -96.82 -9.41 28.79 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -82.67 105.82 14.01 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.45 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -160.93 23.32 0.14 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -169.61 -55.45 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.854 1.262 . . . . 0.0 109.816 -175.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 63.73 67.69 0.62 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.774 -1.557 . . . . 0.0 109.513 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -131.81 65.14 1.58 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.072 -1.422 . . . . 0.0 107.851 175.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -89.07 99.34 12.35 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.209 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 73.57 120.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.821 1.325 . . . . 0.0 111.926 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.3 -35.05 61.33 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.774 178.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.2 ttt 57.35 65.53 1.34 Allowed 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.282 -178.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -68.55 -37.28 79.81 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.019 -173.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.0 mt -107.12 -68.05 0.91 Allowed 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -179.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 C--N 1.312 -1.037 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.954 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG12 ' A' ' 25' ' ' VAL . 31.3 t70 . . . . . 0 C--O 1.253 1.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.404 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.404 ' HG ' HG13 ' A' ' 25' ' ' VAL . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.445 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD1' HD11 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.467 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 77.9 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 73' ' ' ALA . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.481 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.476 HD11 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.558 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.517 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.43 ' HB2' HG21 ' A' ' 100' ' ' VAL . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.43 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.481 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp . . . . . 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.515 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.6 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 110.741 -0.096 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.509 ' O ' HG22 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.579 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.66 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.579 HD13 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 61' ' ' ILE . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HA ' ' CG ' ' A' ' 63' ' ' ASN . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 57' ' ' THR . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.409 ' CG ' ' HA ' ' A' ' 60' ' ' GLU . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.4 ' C ' ' HB2' ' A' ' 70' ' ' PHE . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HB2' ' C ' ' A' ' 65' ' ' LEU . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.66 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB3' HG11 ' A' ' 108' ' ' VAL . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 108' ' ' VAL . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.404 HD11 ' HB ' ' A' ' 40' ' ' VAL . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.439 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.403 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 95' ' ' LEU . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 93' ' ' PHE . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.454 HG12 HD22 ' A' ' 81' ' ' LEU . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG12 ' A' ' 25' ' ' VAL . 7.6 t70 . . . . . 0 CA--C 1.486 -1.507 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 25' ' ' VAL . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.558 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.68 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.45 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.522 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.68 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 77' ' ' PHE . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.438 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.574 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.574 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.438 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.477 HG11 ' HB1' ' A' ' 112' ' ' ALA . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' HE22 ' A' ' 62' ' ' GLN . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.477 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.499 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 40' ' ' VAL . 2.4 t-20 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.469 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.426 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.426 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.444 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 83.3 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.513 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.477 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.658 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.435 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 95' ' ' LEU . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.477 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.433 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.477 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 113' ' ' LYS . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.522 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 . . . . . 0 CA--C 1.485 -1.53 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.432 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.417 ' HG ' HG13 ' A' ' 25' ' ' VAL . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.53 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.478 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HB3' HD13 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.491 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.446 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.446 ' HD2' ' H ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.535 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.535 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm . . . . . 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.488 ' O ' HG12 ' A' ' 25' ' ' VAL . 12.0 t70 . . . . . 0 CA--C 1.489 -1.366 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.5 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG3' ' HB3' ' A' ' 55' ' ' PRO . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.48 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt . . . . . 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' HD21 ' A' ' 74' ' ' LEU . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 29' ' ' GLU . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.428 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.432 HD21 ' HB2' ' A' ' 26' ' ' LEU . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.46 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.424 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 58.3 tpp . . . . . 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.497 ' O ' HG12 ' A' ' 25' ' ' VAL . 28.3 t70 . . . . . 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.423 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.4 HD13 ' CE ' ' A' ' 31' ' ' MET . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.495 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.507 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.545 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.433 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.655 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.453 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.508 ' C ' HD12 ' A' ' 65' ' ' LEU . 69.6 mm-40 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.507 ' CD ' ' HA ' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.494 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.414 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.687 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.687 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.534 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp . . . . . 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.553 ' O ' HG12 ' A' ' 25' ' ' VAL . 6.5 t70 . . . . . 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.553 HG12 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' HG13 ' A' ' 25' ' ' VAL . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.436 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.565 ' O ' HG22 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.495 ' HB3' HD13 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HB2' HG12 ' A' ' 61' ' ' ILE . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.497 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.575 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.575 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 108' ' ' VAL . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.443 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.402 HG12 HD22 ' A' ' 81' ' ' LEU . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.409 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm . . . . . 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.5 -0.965 0 CA-C-O 121.568 0.699 . . . . 0.0 109.856 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.505 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.518 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 61' ' ' ILE . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.492 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.512 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 42' ' ' GLU . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.512 HD13 ' HB3' ' A' ' 41' ' ' GLN . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HB2' HG12 ' A' ' 61' ' ' ILE . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.438 HG23 HD12 ' A' ' 65' ' ' LEU . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.404 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.404 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 81' ' ' LEU . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.518 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.676 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.544 ' HB2' HD13 ' A' ' 95' ' ' LEU . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.518 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 25' ' ' VAL . 19.6 t70 . . . . . 0 CA--C 1.494 -1.182 0 CA-C-O 120.982 0.42 . . . . 0.0 110.086 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD23 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.488 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.444 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.408 HD21 HD11 ' A' ' 54' ' ' LEU . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.548 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.567 HD13 ' HB3' ' A' ' 41' ' ' GLN . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HB2' HG12 ' A' ' 61' ' ' ILE . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.646 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.408 ' CE2' HD22 ' A' ' 74' ' ' LEU . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 70' ' ' PHE . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.472 HD12 HD22 ' A' ' 89' ' ' LEU . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.67 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.422 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.67 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.434 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.434 HG12 ' HA ' ' A' ' 97' ' ' ALA . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 115' ' ' MET . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.7 mmm . . . . . 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.453 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.48 ' O ' HD13 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.48 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 54' ' ' LEU . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.521 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.549 HD13 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.408 HG23 HD12 ' A' ' 65' ' ' LEU . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.408 HD12 HG23 ' A' ' 61' ' ' ILE . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.515 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.521 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.416 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 77' ' ' PHE . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.641 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HB2' HD13 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.475 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm . . . . . 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.0 t70 . . . . . 0 CA--C 1.486 -1.491 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG13 ' A' ' 25' ' ' VAL . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.601 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.601 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.478 HG21 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.563 ' SD ' HD13 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.482 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.444 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.483 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.656 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.656 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 0.5 OUTLIER -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.516 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 HG12 ' A' ' 108' ' ' VAL . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.484 HD11 ' HB ' ' A' ' 40' ' ' VAL . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.501 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' ' 95' ' ' LEU . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.408 HG12 HD22 ' A' ' 81' ' ' LEU . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.478 ' SD ' HG21 ' A' ' 30' ' ' ILE . 48.2 ttm . . . . . 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.405 ' O ' HG12 ' A' ' 25' ' ' VAL . 38.1 t70 . . . . . 0 CA--C 1.5 -0.946 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.447 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.447 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.422 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.647 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.428 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 61' ' ' ILE . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.405 HD23 HD13 ' A' ' 22' ' ' LEU . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.679 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 89' ' ' LEU . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.549 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.46 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' CYS . . . . . 0.494 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.422 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm . . . . . 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.9 t70 . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.181 0.515 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.427 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 25' ' ' VAL . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.457 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 2.2 t-20 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.546 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.414 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 41' ' ' GLN . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.642 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 13.6 mm100 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.642 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 22' ' ' LEU . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD12 HD22 ' A' ' 89' ' ' LEU . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.468 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HA ' HE21 ' A' ' 92' ' ' GLN . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 89' ' ' LEU . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.468 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.414 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.531 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.46 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.46 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.51 ' ND2' ' HB3' ' A' ' 39' ' ' ASP . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.51 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.586 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.53 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD12 HG23 ' A' ' 61' ' ' ILE . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.529 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.529 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.426 ' HB2' HG23 ' A' ' 100' ' ' VAL . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.572 ' HB2' HD13 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.45 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.49 ' HG2' ' HB1' ' A' ' 114' ' ' ALA . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 97' ' ' ALA . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HA ' ' HE2' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.49 ' HB1' ' HG2' ' A' ' 98' ' ' GLU . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.582 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.2 t70 . . . . . 0 CA--C 1.497 -1.087 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.452 HD13 HD23 ' A' ' 74' ' ' LEU . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.517 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.449 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 HD13 ' A' ' 22' ' ' LEU . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.504 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HB2' HD13 ' A' ' 95' ' ' LEU . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.504 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.485 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.485 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm . . . . . 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.402 ' O ' HG12 ' A' ' 25' ' ' VAL . 13.0 t70 . . . . . 0 CA--C 1.506 -0.727 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.509 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.443 ' HB3' HD13 ' A' ' 54' ' ' LEU . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.498 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 41' ' ' GLN . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.443 HD12 HG23 ' A' ' 61' ' ' ILE . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.477 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.498 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.46 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.406 HD22 HG12 ' A' ' 108' ' ' VAL . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.674 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.674 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 97' ' ' ALA . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.406 HG12 HD22 ' A' ' 81' ' ' LEU . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 21.5 t70 . . . . . 0 CA--C 1.494 -1.207 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.418 HD13 HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.494 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.483 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.516 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.596 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.416 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.465 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.447 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.544 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.544 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.418 HD23 HD13 ' A' ' 22' ' ' LEU . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.596 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.469 ' HB3' HG11 ' A' ' 108' ' ' VAL . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.428 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.401 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.401 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.53 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.469 HG11 ' HB3' ' A' ' 78' ' ' SER . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm . . . . . 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.438 ' HG ' HG13 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.487 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.559 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.559 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.517 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . 0.58 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.474 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.561 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 97' ' ' ALA . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.505 -0.767 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -136.26 -138.58 0.15 Allowed 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.5 75.57 0.32 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 122.191 0.996 . . . . 0.0 110.062 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.5 111.95 30.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-N 114.124 -1.398 . . . . 0.0 109.432 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 tt -84.89 88.79 7.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.66 101.92 5.17 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.44 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 t -89.79 82.69 6.22 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-O 122.512 1.149 . . . . 0.0 109.51 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -132.28 28.19 4.41 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -80.85 82.67 6.78 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.517 -1.219 . . . . 0.0 111.704 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.498 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 53.3 t -87.58 -51.05 0.42 Allowed Pre-proline 0 C--N 1.301 -1.505 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.03 174.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 10' ' ' VAL . 21.0 Cg_endo -98.85 -169.72 0.11 Allowed 'Trans proline' 0 N--CA 1.437 -1.824 0 C-N-CA 121.597 1.531 . . . . 0.0 110.867 174.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.89 152.27 28.1 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.16 96.2 0.1 Allowed Glycine 0 N--CA 1.427 -1.953 0 C-N-CA 118.731 -1.7 . . . . 0.0 113.244 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.29 153.98 56.33 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 121.979 1.786 . . . . 0.0 109.704 173.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.43 93.57 3.48 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -178.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.81 -164.6 40.14 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.178 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -115.66 138.59 14.74 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -93.64 -34.35 13.32 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.424 -177.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.59 -59.23 2.3 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -178.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -92.87 106.78 18.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.72 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG12 ' A' ' 25' ' ' VAL . 31.3 t70 -74.43 114.3 12.66 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.295 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.404 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.404 ' HG ' HG13 ' A' ' 25' ' ' VAL . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.445 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD1' HD11 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.467 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 77.9 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 73' ' ' ALA . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.481 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.476 HD11 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.517 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.43 ' HB2' HG21 ' A' ' 100' ' ' VAL . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.43 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.481 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.441 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp -58.57 -59.88 4.68 Favored 'General case' 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.319 2.2 pp0? -77.96 -6.49 54.59 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.793 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -89.37 -36.04 15.73 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.312 174.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -99.37 -38.9 8.65 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.62 14.28 13.69 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -51.02 110.64 1.85 Allowed Pre-proline 0 C--O 1.247 0.944 0 C-N-CA 126.407 1.883 . . . . 0.0 109.373 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.78 77.13 4.2 Favored 'Trans proline' 0 N--CA 1.432 -2.121 0 C-N-CA 122.342 2.028 . . . . 0.0 112.994 -175.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -121.72 9.52 10.15 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 46.55 59.28 3.98 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 126.261 1.824 . . . . 0.0 113.518 -177.044 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -92.64 96.25 10.07 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -139.6 113.47 8.69 Favored 'General case' 0 C--N 1.284 -2.272 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.47 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 113.56 42.62 0.87 Allowed Glycine 0 C--N 1.297 -1.621 0 C-N-CA 120.325 -0.941 . . . . 0.0 113.617 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -78.82 100.97 7.39 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.182 0.992 . . . . 0.0 109.255 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 53.4 m -149.94 134.93 17.86 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.642 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -89.99 72.95 7.4 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.291 0.567 . . . . 0.0 111.772 177.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -122.44 3.95 9.67 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -152.44 166.3 32.35 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -178.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt 82.98 123.38 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.906 1.682 . . . . 0.0 110.486 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.25 85.66 3.74 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -81.92 -13.95 56.81 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.387 0.613 . . . . 0.0 110.551 -176.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -125.37 105.8 9.36 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.98 172.8 6.63 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.374 -175.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -90.92 174.23 7.55 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.8 tpt -116.03 -23.37 8.55 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 121.112 0.482 . . . . 0.0 110.515 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.5 t -83.44 110.96 18.6 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.224 -174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 85.8 mt 69.89 -42.12 0.5 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.678 1.591 . . . . 0.0 114.768 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 C--N 1.301 -1.506 0 C-N-CA 123.203 0.601 . . . . 0.0 111.379 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -56.46 -63.24 1.26 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.993 0.517 . . . . 0.0 111.15 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.63 -50.88 0.13 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 ' N ' ' A' ' 5' ' ' LEU . 2.4 pp -52.25 -32.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -171.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 4' ' ' ILE . 56.4 tp -142.06 98.14 3.27 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.17 69.25 1.0 Allowed 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 m -90.55 -46.37 8.35 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.82 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -83.74 61.22 6.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.582 0.706 . . . . 0.0 112.596 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -174.79 -179.49 1.46 Allowed 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.801 0.84 . . . . 0.0 110.644 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.529 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 17.3 m -88.2 174.15 5.49 Favored Pre-proline 0 C--N 1.303 -1.455 0 C-N-CA 124.298 1.039 . . . . 0.0 108.5 175.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 5.6 Cg_exo -38.39 -52.4 1.96 Allowed 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 124.13 3.22 . . . . 0.0 113.153 175.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.53 171.75 0.19 Allowed 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.592 1.157 . . . . 0.0 113.449 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.76 121.0 0.95 Allowed Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.332 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -55.57 -45.09 42.12 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.475 2.117 . . . . 0.0 110.976 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.69 99.55 8.48 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -79.21 77.64 1.81 Allowed Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.81 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.79 152.93 23.9 Favored Glycine 0 N--CA 1.43 -1.765 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -115.61 147.73 40.44 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 117.194 0.497 . . . . 0.0 111.605 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -150.21 153.32 36.04 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.5 t 55.96 82.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 124.389 1.055 . . . . 0.0 110.367 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.515 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.6 t70 -66.44 124.06 21.71 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.509 ' O ' HG22 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.579 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.66 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.579 HD13 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 61' ' ' ILE . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HA ' ' CG ' ' A' ' 63' ' ' ASN . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 57' ' ' THR . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.409 ' CG ' ' HA ' ' A' ' 60' ' ' GLU . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.4 ' C ' ' HB2' ' A' ' 70' ' ' PHE . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HB2' ' C ' ' A' ' 65' ' ' LEU . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.477 ' HA ' HD13 ' A' ' 4' ' ' ILE . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.428 ' HA3' ' CG1' ' A' ' 4' ' ' ILE . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.66 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB3' HG11 ' A' ' 108' ' ' VAL . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 108' ' ' VAL . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.404 HD11 ' HB ' ' A' ' 40' ' ' VAL . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.439 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.403 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 95' ' ' LEU . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 93' ' ' PHE . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.454 HG12 HD22 ' A' ' 81' ' ' LEU . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm -66.02 -57.09 8.54 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.275 0.3 OUTLIER -67.45 -26.64 66.49 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -175.9 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.31 -30.69 25.36 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.441 -0.903 . . . . 0.0 112.535 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.69 -39.13 15.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.445 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.86 68.95 7.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.956 0.884 . . . . 0.0 111.422 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -168.83 117.78 0.6 Allowed Pre-proline 0 C--N 1.301 -1.539 0 CA-C-N 113.62 -1.627 . . . . 0.0 107.248 173.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -73.33 -45.97 0.39 Allowed 'Trans proline' 0 CA--C 1.517 -0.363 0 C-N-CA 122.108 1.872 . . . . 0.0 111.354 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 65.89 179.78 0.2 Allowed 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.633 1.173 . . . . 0.0 111.045 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -98.76 -39.11 8.8 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.414 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt 46.43 74.35 0.15 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.263 1.425 . . . . 0.0 112.79 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -88.96 -69.66 0.7 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.437 -175.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 71.33 -88.73 0.42 Allowed Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.501 ' OD2' ' HG3' ' A' ' 129' ' ' LYS . 27.0 t70 -161.41 -60.83 0.05 Allowed 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 m 56.22 82.77 0.1 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.89 -1.505 . . . . 0.0 113.165 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.501 ' HG3' ' OD2' ' A' ' 127' ' ' ASP . 62.0 mttp -96.99 113.03 24.53 Favored 'General case' 0 CA--C 1.499 -1.004 0 O-C-N 121.491 -0.755 . . . . 0.0 110.535 175.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -95.43 6.37 49.16 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.102 -0.954 . . . . 0.0 108.99 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 131' ' ' LYS . 46.0 mtpt -74.0 81.02 1.7 Allowed 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -102.6 95.3 6.14 Favored 'General case' 0 N--CA 1.415 -2.181 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 167.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -100.95 -4.36 27.76 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.723 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.12 138.06 51.62 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 113.269 -1.787 . . . . 0.0 109.54 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -117.41 111.16 18.94 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 71.06 101.23 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.412 1.085 . . . . 0.0 110.368 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -94.51 105.29 17.25 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 86.4 mtp -131.8 126.66 34.91 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.818 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -107.87 29.3 7.38 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 175.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp 61.23 64.26 1.12 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.533 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 CA--C 1.495 -1.142 0 CA-C-N 113.03 -1.896 . . . . 0.0 107.762 -176.211 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.1 p . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 120.939 0.4 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -153.77 127.21 8.6 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.824 0.85 . . . . 0.0 108.938 177.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.35 -39.03 0.44 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.541 1.536 . . . . 0.0 113.865 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.28 129.59 32.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 C-N-CA 125.051 1.34 . . . . 0.0 111.229 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -115.6 156.2 26.25 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.33 -6.61 25.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -174.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.8 p -90.26 -1.7 57.95 Favored 'General case' 0 C--N 1.305 -1.326 0 C-N-CA 122.972 0.509 . . . . 0.0 110.154 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.8 mmt 61.04 68.01 0.77 Allowed 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.842 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -137.78 136.5 37.31 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.0 t 62.74 95.39 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.535 0 O-C-N 124.136 0.897 . . . . 0.0 109.403 -173.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -79.62 3.59 7.4 Favored 'Trans proline' 0 C--N 1.336 -0.12 0 C-N-CA 122.933 2.422 . . . . 0.0 113.783 -174.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.35 99.54 0.04 OUTLIER 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.483 1.113 . . . . 0.0 111.002 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.11 161.04 34.44 Favored Glycine 0 N--CA 1.422 -2.258 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -81.27 40.01 0.93 Allowed 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.267 2.645 . . . . 0.0 111.283 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.73 110.52 5.62 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.126 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -155.37 119.29 0.91 Allowed Glycine 0 N--CA 1.422 -2.293 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.57 -59.03 4.13 Favored Glycine 0 C--O 1.241 0.572 0 C-N-CA 121.829 -0.224 . . . . 0.0 113.348 177.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 69.32 169.09 0.29 Allowed 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.502 1.521 . . . . 0.0 112.372 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 65.38 -81.84 0.03 OUTLIER 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 110.909 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.1 t -128.38 77.88 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG12 ' A' ' 25' ' ' VAL . 7.6 t70 -96.43 132.05 42.36 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.154 175.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 25' ' ' VAL . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.558 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.68 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.45 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.522 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.68 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 77' ' ' PHE . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.438 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.574 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.574 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.438 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt -58.49 -52.03 67.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.299 0.4 OUTLIER -69.23 -31.16 69.54 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -177.071 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -92.41 -19.18 22.33 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.142 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 -34.94 12.17 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.806 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.75 71.66 9.56 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 122.322 1.058 . . . . 0.0 108.161 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -111.43 136.24 21.0 Favored Pre-proline 0 C--N 1.287 -2.11 0 CA-C-N 113.196 -1.82 . . . . 0.0 110.551 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -70.38 -32.67 15.59 Favored 'Trans proline' 0 C--O 1.251 1.157 0 C-N-CA 122.487 2.125 . . . . 0.0 111.561 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 66.84 160.09 0.14 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.119 1.368 . . . . 0.0 113.706 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.36 -47.07 5.29 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 68.57 -73.99 0.08 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.222 1.409 . . . . 0.0 113.24 175.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.94 81.13 3.49 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.274 1.035 . . . . 0.0 112.361 -174.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 158.33 39.88 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.96 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.137 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.41 -80.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.048 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 33.0 m 54.98 81.79 0.1 Allowed 'General case' 0 C--O 1.247 0.949 0 C-N-CA 123.663 0.785 . . . . 0.0 111.552 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -80.75 74.48 7.69 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.526 1.155 . . . . 0.0 111.382 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -78.26 -38.18 43.34 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 113.533 -1.667 . . . . 0.0 107.758 177.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -127.18 175.84 7.84 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.011 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.25 -169.28 2.55 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 103.214 -2.884 . . . . 0.0 103.214 174.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -73.73 -55.28 6.44 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -142.65 164.81 29.1 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 170.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -108.59 9.31 27.31 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.623 1.201 . . . . 0.0 109.812 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.72 166.46 7.96 Favored 'General case' 0 C--N 1.296 -1.761 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.462 ' OD1' HD23 ' A' ' 140' ' ' LEU . 12.4 t70 -122.09 113.41 19.49 Favored 'General case' 0 C--N 1.282 -2.369 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -9.36 57.2 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -176.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 8.7 m -91.78 -50.49 5.71 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.462 HD23 ' OD1' ' A' ' 137' ' ' ASP . 2.3 pt? -127.21 98.91 5.46 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.537 0.684 . . . . 0.0 111.492 176.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 C--N 1.298 -1.658 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.588 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 N--CA 1.438 -1.03 0 CA-C-O 120.954 0.407 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -127.93 125.7 40.07 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.63 45.46 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.694 0.283 . . . . 0.0 111.701 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 66.9 mt -81.08 88.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -133.75 111.12 10.29 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -112.42 -10.14 13.78 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 173.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.8 t 178.47 -177.64 0.25 Allowed 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.4 mtt -82.3 68.05 8.57 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 120.221 1.373 . . . . 0.0 110.849 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 176.59 139.94 0.07 Allowed 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.5 m -88.27 121.54 70.31 Favored Pre-proline 0 N--CA 1.437 -1.082 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.303 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.3 -0.22 10.55 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.384 2.056 . . . . 0.0 112.629 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.61 94.03 6.75 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.95 -134.1 8.37 Favored Glycine 0 N--CA 1.432 -1.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.936 -178.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.01 -42.32 30.97 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 122.493 2.129 . . . . 0.0 111.343 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 64.82 22.86 12.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.379 1.072 . . . . 0.0 111.777 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -104.82 147.81 16.44 Favored Glycine 0 N--CA 1.429 -1.806 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.039 -176.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.83 77.96 1.16 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 63.89 -90.03 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.232 1.013 . . . . 0.0 109.726 -174.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -128.39 5.89 5.75 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.112 0.482 . . . . 0.0 110.115 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.26 105.75 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.3 121.07 16.94 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.477 HG11 ' HB1' ' A' ' 112' ' ' ALA . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' HE22 ' A' ' 62' ' ' GLN . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.477 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.499 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 40' ' ' VAL . 2.4 t-20 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.469 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.426 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.426 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.444 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 83.3 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.513 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.477 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.658 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.435 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 95' ' ' LEU . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.477 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.433 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.477 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 113' ' ' LYS . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm -63.05 -45.22 93.26 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.277 0.1 OUTLIER -72.57 -22.51 60.99 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -99.77 -8.85 23.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 118.297 -1.361 . . . . 0.0 111.778 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -115.25 -51.89 2.69 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.23 -22.33 28.72 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.672 0.749 . . . . 0.0 110.636 -173.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.428 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 58.6 tptt -106.98 120.52 47.76 Favored Pre-proline 0 C--N 1.291 -1.948 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -72.42 55.52 2.56 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.207 1.938 . . . . 0.0 114.283 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.428 ' HG2' ' HG3' ' A' ' 120' ' ' LYS . 33.5 mm-40 -83.78 -23.53 31.46 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.841 0.829 . . . . 0.0 108.981 175.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -127.01 130.8 50.72 Favored 'General case' 0 N--CA 1.426 -1.662 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.416 ' NZ ' ' HB3' ' A' ' 124' ' ' LYS . 6.5 mtpm? -136.8 -63.64 0.61 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.306 0.574 . . . . 0.0 112.415 -174.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -61.23 103.35 0.28 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.615 -169.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -115.39 -13.46 8.91 Favored Glycine 0 C--N 1.309 -0.924 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -103.3 86.77 2.73 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 45.6 m -143.58 133.14 23.56 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.16 -39.84 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.125 0.266 . . . . 0.0 111.226 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 32.6 t70 42.62 -87.93 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.492 1.917 . . . . 0.0 114.374 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -151.31 171.79 16.91 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.77 0.795 . . . . 0.0 109.694 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -124.08 85.3 2.39 Favored 'General case' 0 N--CA 1.414 -2.265 1 N-CA-C 100.029 -4.063 . . . . 0.0 100.029 165.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.1 -25.98 68.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.147 -1.388 . . . . 0.0 114.327 -164.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -70.31 162.51 28.4 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -73.02 82.96 1.25 Allowed 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.505 0.669 . . . . 0.0 112.038 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 76.99 159.12 0.21 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.815 2.046 . . . . 0.0 109.71 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -73.01 -17.23 61.47 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.794 0.807 . . . . 0.0 109.976 178.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 62.0 mtt 72.96 -81.96 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.676 1.591 . . . . 0.0 114.003 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 19.8 m 62.93 14.13 7.22 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.94 0.896 . . . . 0.0 112.397 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.7 pp -99.55 -15.49 18.61 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.688 -177.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.25 1.104 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 177.636 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.2 t . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -104.84 -11.47 16.75 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.86 -16.78 0.44 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.535 1.534 . . . . 0.0 113.233 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mt -83.42 84.55 1.87 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-O 121.67 0.747 . . . . 0.0 109.137 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 tt -133.14 80.36 1.88 Allowed 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.47 104.51 16.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.365 -177.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.5 m -85.22 -33.85 22.14 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -121.53 88.52 2.95 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.915 177.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -125.71 72.32 1.27 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.992 0.901 . . . . 0.0 108.825 172.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -137.9 112.09 8.86 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -178.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.27 -67.95 0.04 OUTLIER 'Trans proline' 0 C--O 1.243 0.744 0 C-N-CA 121.8 1.667 . . . . 0.0 111.338 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.99 175.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.682 1.193 . . . . 0.0 112.777 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 134.16 139.89 4.21 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.344 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -77.49 146.36 24.37 Favored 'Trans proline' 0 C--O 1.245 0.846 0 C-N-CA 122.609 2.206 . . . . 0.0 111.898 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.76 -68.84 0.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.818 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 131.68 -162.45 23.78 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.59 8.07 7.8 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.027 178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -70.77 -42.55 70.25 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.879 0.371 . . . . 0.0 110.398 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -129.58 127.54 40.88 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 173.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t 64.74 82.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 124.284 0.99 . . . . 0.0 108.593 -172.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.522 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 -93.73 121.58 35.31 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.288 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.417 ' HG ' HG13 ' A' ' 25' ' ' VAL . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.53 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.478 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HB3' HD13 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.491 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.446 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.446 ' HD2' ' H ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 66.2 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.535 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.535 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm -58.36 -58.6 7.78 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.585 ' O ' ' HB3' ' A' ' 120' ' ' LYS 0.316 0.0 OUTLIER -75.45 -5.84 47.1 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -177.832 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -93.69 -10.54 34.08 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 121.44 -0.788 . . . . 0.0 111.467 173.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -114.66 -52.97 2.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.079 0.466 . . . . 0.0 111.09 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.61 83.63 2.12 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 116' ' ' GLN . 19.8 pttp -105.97 120.89 47.52 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.22 -176.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.1 8.59 4.54 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.408 2.072 . . . . 0.0 112.566 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -26.09 25.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -160.21 130.26 5.34 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -113.9 161.33 17.76 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.297 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 68.6 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.243 1.417 . . . . 0.0 112.475 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.41 146.67 20.98 Favored Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 109.841 -1.304 . . . . 0.0 109.841 -176.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -133.73 164.88 26.24 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 p -66.36 -77.63 0.06 Allowed 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 124.136 0.898 . . . . 0.0 111.753 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? 54.43 36.49 25.66 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -177.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -63.31 -52.57 61.36 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.715 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 57.68 -174.06 0.08 Allowed 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.119 0.967 . . . . 0.0 112.256 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -126.89 81.8 2.04 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.33 -55.44 3.66 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -74.82 108.76 7.77 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 171.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.83 -61.05 1.94 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 53.82 91.16 0.03 OUTLIER 'General case' 0 C--O 1.239 0.517 0 C-N-CA 125.393 1.477 . . . . 0.0 112.224 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -102.92 128.27 49.79 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' MET . . . . . 0.488 ' HB2' ' O ' ' A' ' 141' ' ' ASP . 25.9 ptt? -78.93 87.33 4.76 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.299 1.047 . . . . 0.0 109.267 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -107.94 -47.38 3.59 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.342 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.9 tt -80.43 -47.28 14.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.488 ' O ' ' HB2' ' A' ' 138' ' ' MET . 37.2 t70 . . . . . 0 N--CA 1.434 -1.23 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.66 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.428 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 6.2 m . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -93.32 133.9 36.09 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.906 0.384 . . . . 0.0 110.071 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -89.21 -30.79 18.28 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 pt -80.48 89.56 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-O 122.736 1.255 . . . . 0.0 109.603 174.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.1 mt -85.29 91.89 8.29 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-N 114.022 -1.445 . . . . 0.0 108.787 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.98 15.78 24.97 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.574 -177.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.1 p -88.31 -8.03 55.78 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.989 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 87.4 mtp 69.62 23.51 5.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.176 0.99 . . . . 0.0 111.275 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -96.95 141.3 30.3 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.51 107.16 55.19 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.49 -46.93 1.67 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.174 1.916 . . . . 0.0 111.058 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.46 61.6 6.68 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.577 0.703 . . . . 0.0 110.282 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -120.0 102.97 0.91 Allowed Glycine 0 N--CA 1.437 -1.264 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.99 120.86 8.52 Favored 'Trans proline' 0 C--O 1.248 0.991 0 C-N-CA 123.104 2.536 . . . . 0.0 112.75 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -157.69 104.44 1.96 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.67 133.74 5.52 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.201 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.64 170.96 13.48 Favored Glycine 0 C--N 1.298 -1.56 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -90.38 173.04 8.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 117.074 0.437 . . . . 0.0 110.839 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 68.19 -88.68 0.03 OUTLIER 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.684 1.194 . . . . 0.0 111.94 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 109' ' ' GLU . 21.5 t -121.82 96.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.488 ' O ' HG12 ' A' ' 25' ' ' VAL . 12.0 t70 -99.93 98.9 9.62 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 173.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.5 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG3' ' HB3' ' A' ' 55' ' ' PRO . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.428 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.48 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HB3' HG21 ' A' ' 20' ' ' VAL . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.599 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt -61.65 -59.3 5.4 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.271 0.0 OUTLIER -73.51 -22.8 60.03 Favored 'General case' 0 C--O 1.2 -1.515 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.306 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -73.68 -22.17 60.02 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.485 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -98.16 -36.63 10.0 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.239 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.67 87.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -116.15 105.38 50.99 Favored Pre-proline 0 N--CA 1.431 -1.408 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.6 49.71 0.52 Allowed 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.446 2.764 . . . . 0.0 112.712 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -55.75 -25.05 38.74 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.33 166.39 24.9 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.385 172.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -148.05 140.34 24.3 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.64 -16.76 21.84 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.283 0.563 . . . . 0.0 110.27 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 130.45 118.24 2.0 Favored Glycine 0 N--CA 1.423 -2.207 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.069 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.463 ' O ' ' HB ' ' A' ' 128' ' ' THR . 9.2 t70 -81.33 146.7 30.23 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 127' ' ' ASP . 95.8 m 77.8 -20.23 0.39 Allowed 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 123.252 0.621 . . . . 0.0 112.307 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 65.66 83.42 0.17 Allowed 'General case' 0 CA--C 1.506 -0.726 0 C-N-CA 124.374 1.07 . . . . 0.0 109.374 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -113.07 135.21 54.05 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.244 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 38.8 mttp 67.83 71.08 0.33 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.379 1.072 . . . . 0.0 108.433 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -79.82 -26.11 40.59 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -117.3 151.71 36.4 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.16 140.54 31.68 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.24 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -83.59 -37.07 23.4 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.077 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 67.14 111.76 0.04 OUTLIER 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.589 1.156 . . . . 0.0 111.64 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -79.56 -69.39 0.58 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.541 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 53.4 ttm -154.92 102.48 2.34 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-O 121.436 0.636 . . . . 0.0 111.815 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.5 m -91.0 98.18 11.62 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 115.136 -0.938 . . . . 0.0 108.719 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 62.1 tp -177.35 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.5 179.034 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.3 t30 74.55 149.35 0.1 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.166 0.986 . . . . 0.0 109.683 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.89 -47.35 83.69 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.808 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 80.2 mt 69.8 -59.24 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 125.275 1.43 . . . . 0.0 112.164 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.9 tp 72.33 -51.46 0.7 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.424 1.49 . . . . 0.0 112.53 177.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.78 14.31 7.21 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.587 1.155 . . . . 0.0 112.571 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.5 m -99.05 156.84 16.72 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.4 ttp 71.17 19.69 5.38 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 122.906 1.336 . . . . 0.0 109.229 -177.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -146.46 87.11 1.7 Allowed 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.18 93.36 5.48 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -172.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.517 ' HD2' ' OE1' ' A' ' 72' ' ' GLN . 26.5 Cg_exo -66.67 -37.38 21.68 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.167 1.911 . . . . 0.0 110.12 168.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 70.86 158.32 0.18 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.311 1.444 . . . . 0.0 113.15 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.05 108.78 0.21 Allowed Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -79.44 -22.87 7.76 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.04 1.827 . . . . 0.0 112.192 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' HD21 ' A' ' 22' ' ' LEU . . . 60.08 19.56 8.77 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.575 1.15 . . . . 0.0 111.492 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -159.6 -113.82 0.35 Allowed Glycine 0 N--CA 1.425 -2.057 0 N-CA-C 106.243 -2.743 . . . . 0.0 106.243 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.95 -66.69 0.54 Allowed Glycine 0 C--N 1.305 -1.176 0 C-N-CA 119.308 -1.425 . . . . 0.0 113.862 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -70.43 -49.05 52.83 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.931 0.872 . . . . 0.0 109.182 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.82 168.9 18.67 Favored 'General case' 0 N--CA 1.416 -2.151 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t 65.95 89.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 O-C-N 124.812 1.32 . . . . 0.0 111.723 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -97.1 98.63 10.21 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' HD21 ' A' ' 74' ' ' LEU . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 29' ' ' GLU . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.428 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.517 ' OE1' ' HD2' ' A' ' 11' ' ' PRO . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.432 HD21 ' HB2' ' A' ' 26' ' ' LEU . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.46 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.424 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 119' ' ' ALA . 58.3 tpp -62.37 -58.51 7.39 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.266 3.9 pp0? -66.75 -19.52 65.77 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -90.39 -18.54 25.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.162 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -102.82 -56.6 2.2 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.419 ' HB3' ' SD ' ' A' ' 115' ' ' MET . . . -107.7 83.77 1.85 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-O 122.2 1.0 . . . . 0.0 110.712 -172.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.492 ' HG3' ' HB2' ' A' ' 122' ' ' GLU . 16.6 tppt? -111.89 104.11 55.77 Favored Pre-proline 0 C--N 1.276 -2.618 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.038 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -76.91 53.32 4.1 Favored 'Trans proline' 0 N--CA 1.482 0.814 0 C-N-CA 123.557 2.838 . . . . 0.0 111.28 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HB2' ' HG3' ' A' ' 120' ' ' LYS . 0.9 OUTLIER -63.89 -67.79 0.4 Allowed 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.218 1.407 . . . . 0.0 111.011 -176.202 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.497 ' CD ' ' H ' ' A' ' 124' ' ' LYS 0.498 0.0 OUTLIER 29.88 -105.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 -175.244 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.525 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 0.0 OUTLIER -173.54 105.42 0.13 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.553 0.741 . . . . 0.0 109.996 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.59 -50.89 3.32 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.042 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.05 10.02 24.96 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.291 -175.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ASP . . . . . 0.525 ' O ' ' HB2' ' A' ' 124' ' ' LYS . 7.4 t70 -144.85 177.16 8.93 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.8 m -106.36 -32.95 7.91 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt 49.02 78.91 0.08 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.256 1.023 . . . . 0.0 112.851 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -156.77 140.95 16.46 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -112.49 124.76 53.23 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -143.69 -29.08 0.52 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.995 168.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -131.78 96.92 4.05 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.993 0.425 . . . . 0.0 111.571 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -137.2 112.64 9.31 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 72.84 -70.01 0.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.023 1.329 . . . . 0.0 110.592 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -155.32 177.23 11.59 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -100.09 148.97 23.99 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.3 ptm -72.4 88.12 1.19 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.725 1.25 . . . . 0.0 111.585 -176.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 3.0 p -110.94 -68.09 0.95 Allowed 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 114.506 -1.225 . . . . 0.0 111.282 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.57 -26.77 34.71 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 122.115 0.96 . . . . 0.0 108.925 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.264 1.861 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.483 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' OD1' HG12 ' A' ' 4' ' ' ILE . 45.3 t30 67.29 96.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.385 1.074 . . . . 0.0 112.504 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.5 72.67 1.5 Allowed 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.889 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.427 HG12 ' OD1' ' A' ' 2' ' ' ASN . 34.9 pt -129.31 5.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.879 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.55 120.61 30.05 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.09 116.21 32.19 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.286 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -100.3 -105.43 0.23 Allowed 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.2 ttt -95.66 -43.33 7.96 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 168.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -82.1 143.92 31.15 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.6 p -129.95 101.42 18.23 Favored Pre-proline 0 C--N 1.291 -1.962 0 CA-C-O 121.046 0.451 . . . . 0.0 110.903 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -73.05 -42.09 1.12 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.094 1.196 . . . . 0.0 110.077 176.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.79 -177.47 0.36 Allowed 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.95 179.03 18.43 Favored Glycine 0 N--CA 1.431 -1.698 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -84.93 91.31 0.75 Allowed 'Trans proline' 0 N--CA 1.437 -1.84 0 C-N-CA 122.238 1.959 . . . . 0.0 111.241 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.23 121.14 26.26 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.828 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.15 -75.88 1.87 Allowed Glycine 0 N--CA 1.433 -1.548 0 N-CA-C 111.179 -0.768 . . . . 0.0 111.179 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.8 26.73 21.58 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.594 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 65.77 173.34 0.23 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.229 1.012 . . . . 0.0 112.68 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -91.58 -23.45 19.89 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -100.93 96.66 4.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.497 ' O ' HG12 ' A' ' 25' ' ' VAL . 28.3 t70 -89.83 116.45 27.93 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.423 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.4 HD13 ' CE ' ' A' ' 31' ' ' MET . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.495 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.507 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.545 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.433 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.655 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.453 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.508 ' C ' HD12 ' A' ' 65' ' ' LEU . 69.6 mm-40 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.507 ' CD ' ' HA ' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.494 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.414 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.687 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.687 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.534 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp -68.04 -55.01 14.12 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.281 0.6 OUTLIER -61.33 -26.29 67.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -176.547 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -84.35 -57.0 3.34 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.19 0.519 . . . . 0.0 111.628 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -86.97 -11.24 51.12 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.82 5.8 20.42 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.151 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -101.16 95.08 4.42 Favored Pre-proline 0 C--N 1.31 -1.13 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.72 -21.71 16.25 Favored 'Trans proline' 0 C--O 1.241 0.655 0 C-N-CA 122.569 2.179 . . . . 0.0 114.189 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 68.01 -87.57 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.648 1.179 . . . . 0.0 111.833 -177.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -149.77 170.86 17.75 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -74.7 -42.57 58.15 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.925 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -67.07 127.4 32.45 Favored 'General case' 0 N--CA 1.425 -1.686 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -175.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.82 77.43 1.99 Allowed Glycine 0 C--N 1.29 -2.002 0 N-CA-C 106.724 -2.55 . . . . 0.0 106.724 169.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.12 -36.16 83.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 122.973 0.509 . . . . 0.0 111.336 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.7 m -66.1 130.68 44.09 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -82.48 88.95 6.6 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -171.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -111.75 95.45 5.5 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' A' ' 132' ' ' LYS . 54.4 tttm -113.8 -16.48 12.25 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.969 -175.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 131' ' ' LYS . 5.2 ptpp? 89.31 9.62 0.09 Allowed 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 128.05 2.54 . . . . 0.0 108.199 -171.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -129.77 110.84 12.07 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.897 -1.501 . . . . 0.0 108.451 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.44 84.77 4.58 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 122.257 1.027 . . . . 0.0 108.643 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -88.25 86.32 7.06 Favored 'General case' 0 N--CA 1.414 -2.231 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.449 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -84.04 171.95 12.45 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 113.462 -1.699 . . . . 0.0 109.135 -177.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.81 96.88 10.35 Favored 'General case' 0 CA--C 1.484 -1.583 0 C-N-CA 118.998 -1.081 . . . . 0.0 108.563 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.4 ttt -115.6 79.18 1.26 Allowed 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.7 p -80.07 -55.73 4.74 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.972 -1.467 . . . . 0.0 112.085 -173.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -158.2 88.96 0.97 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.422 0.63 . . . . 0.0 110.932 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--N 1.299 -1.624 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 175.918 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.889 0.376 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -83.36 -23.45 32.46 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 122.992 0.517 . . . . 0.0 109.788 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.38 -69.23 0.19 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.793 1.637 . . . . 0.0 112.655 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -87.94 156.6 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.055 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.705 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mp -99.04 -10.49 22.55 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 74.03 -45.92 0.61 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.834 1.654 . . . . 0.0 109.998 -174.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 m 60.68 24.54 14.34 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 122.683 1.23 . . . . 0.0 109.804 176.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.2 tpt -119.63 1.42 11.11 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.468 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 p30 52.51 26.33 4.19 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 126.04 1.736 . . . . 0.0 113.843 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.8 t -128.55 119.67 20.49 Favored Pre-proline 0 C--N 1.311 -1.106 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -65.96 -33.55 41.76 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.945 1.764 . . . . 0.0 111.96 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 71.15 152.92 0.12 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.285 1.434 . . . . 0.0 113.059 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.98 89.57 0.42 Allowed Glycine 0 N--CA 1.435 -1.403 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 178.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.06 -41.65 65.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.196 2.598 . . . . 0.0 112.428 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 58.56 -166.26 0.16 Allowed 'General case' 0 C--O 1.252 1.202 0 C-N-CA 124.265 1.026 . . . . 0.0 112.657 178.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.42 64.67 0.16 Allowed Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.09 -174.08 47.19 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -173.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -91.56 73.32 5.95 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 118.407 1.104 . . . . 0.0 112.069 178.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -83.37 171.19 13.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 114.9 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.553 ' O ' HG12 ' A' ' 25' ' ' VAL . 6.5 t70 -77.27 129.96 36.58 Favored 'General case' 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.553 HG12 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' HG13 ' A' ' 25' ' ' VAL . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.436 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.565 ' O ' HG22 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.495 ' HB3' HD13 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HB2' HG12 ' A' ' 61' ' ' ILE . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.497 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.575 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.575 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 108' ' ' VAL . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.443 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.402 HG12 HD22 ' A' ' 81' ' ' LEU . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm -60.1 -57.31 13.39 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.403 ' HG2' HG23 ' A' ' 25' ' ' VAL . 5.2 pp0? -81.24 -5.91 58.28 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 119.823 -0.751 . . . . 0.0 112.911 -176.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -83.26 -39.08 21.33 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.939 171.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -80.87 -58.62 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.952 0.406 . . . . 0.0 110.595 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.5 45.25 1.25 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -65.04 115.91 25.32 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.181 -175.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -75.76 69.76 6.01 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.792 2.328 . . . . 0.0 110.47 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -146.22 -50.22 0.22 Allowed 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -108.44 -172.85 2.14 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.492 177.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 125' ' ' GLU . 7.3 ttmm -127.8 156.8 41.92 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 174.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -76.31 71.41 3.0 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.505 1.145 . . . . 0.0 111.324 178.658 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -149.84 17.46 1.09 Allowed Glycine 0 N--CA 1.439 -1.146 0 CA-C-N 112.884 -1.962 . . . . 0.0 108.419 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -137.54 110.48 7.7 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 4.4 m -73.07 -28.95 62.6 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.71 0.632 . . . . 0.0 110.481 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt 62.37 32.89 16.71 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-O 122.42 1.105 . . . . 0.0 108.329 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -93.03 134.96 34.64 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.419 -1.264 . . . . 0.0 109.086 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -176.87 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -176.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -139.83 93.79 2.69 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.357 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -79.79 -53.02 7.19 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.376 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 68.76 177.08 0.26 Allowed 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.991 -175.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -92.19 88.11 6.36 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.721 -175.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 71.42 -53.36 0.68 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.858 1.663 . . . . 0.0 111.705 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.7 t70 64.76 76.62 0.34 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 125.891 1.676 . . . . 0.0 111.11 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.43 -176.66 4.81 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.783 -1.098 . . . . 0.0 111.063 -175.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 79.7 p 68.68 -42.46 0.48 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 127.254 2.222 . . . . 0.0 114.044 177.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.53 -25.64 60.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.172 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.0 t70 . . . . . 0 CA--C 1.499 -1.0 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.09 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 120.109 0.004 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.27 -79.89 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.745 0.307 . . . . 0.0 111.046 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.97 -4.07 18.22 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.241 0.543 . . . . 0.0 110.013 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp -99.99 101.28 11.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.0 mt -113.27 85.1 2.12 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.8 34.22 0.18 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.682 -173.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.49 ' HA ' ' HA2' ' A' ' 51' ' ' GLY . 7.2 t -77.44 -45.47 25.66 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 119.545 -0.862 . . . . 0.0 108.842 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 83.5 mtp 45.46 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.872 1.669 . . . . 0.0 114.879 177.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.502 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 60.4 t30 -99.76 120.22 39.38 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.5 t -110.19 95.03 19.9 Favored Pre-proline 0 C--N 1.307 -1.27 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 5.5 Cg_exo -81.7 -26.07 3.31 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.325 2.016 . . . . 0.0 111.148 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 63.37 -165.43 0.24 Allowed 'General case' 0 C--O 1.253 1.238 0 C-N-CA 124.225 1.01 . . . . 0.0 111.192 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -174.49 111.53 0.37 Allowed Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.48 -54.24 1.83 Allowed 'Trans proline' 0 C--O 1.246 0.918 0 C-N-CA 122.703 2.269 . . . . 0.0 111.415 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB1' HD21 ' A' ' 22' ' ' LEU . . . 66.15 -59.99 0.31 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.719 1.608 . . . . 0.0 112.227 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.99 -164.01 39.61 Favored Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.78 113.93 2.4 Favored Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 119.919 -1.134 . . . . 0.0 111.975 -178.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 71.98 -74.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.208 1.403 . . . . 0.0 111.844 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -88.38 94.07 9.73 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.807 -0.179 . . . . 0.0 110.958 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.2 t 49.08 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 125.695 1.598 . . . . 0.0 112.12 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.09 101.48 1.84 Allowed 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 119.591 -0.843 . . . . 0.0 109.856 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.42 HD21 ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.505 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.518 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 61' ' ' ILE . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.492 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.512 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 42' ' ' GLU . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . 0.49 ' HA2' ' HA ' ' A' ' 7' ' ' THR . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.512 HD13 ' HB3' ' A' ' 41' ' ' GLN . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HB2' HG12 ' A' ' 61' ' ' ILE . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.438 HG23 HD12 ' A' ' 65' ' ' LEU . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.404 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.404 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 81' ' ' LEU . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.518 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.676 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.544 ' HB2' HD13 ' A' ' 95' ' ' LEU . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.518 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.63 -49.11 64.6 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.432 ' HG2' HG23 ' A' ' 25' ' ' VAL . 1.2 pp0? -72.24 -30.95 65.37 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -87.03 -14.06 42.63 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.303 -0.959 . . . . 0.0 112.609 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -104.83 -57.64 2.0 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.55 63.42 Favored 'General case' 0 CA--C 1.503 -0.833 0 O-C-N 123.361 0.413 . . . . 0.0 111.549 -173.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 116' ' ' GLN . 52.3 tptt -104.11 99.33 16.48 Favored Pre-proline 0 N--CA 1.428 -1.535 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.86 92.7 1.03 Allowed 'Trans proline' 0 N--CA 1.436 -1.906 0 C-N-CA 121.752 1.635 . . . . 0.0 113.35 -174.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.91 84.32 7.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.4 121.64 6.2 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 -178.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -124.66 -66.89 0.94 Allowed 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.876 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.54 -78.23 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.804 1.242 . . . . 0.0 109.633 -176.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.61 -96.43 0.29 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -89.65 113.89 25.43 Favored 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' THR . . . . . 0.504 HG22 ' HB2' ' A' ' 130' ' ' ASP . 5.7 m -82.23 -52.67 6.74 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.708 -171.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm 58.84 29.02 18.24 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.164 0.586 . . . . 0.0 111.933 -178.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.504 ' HB2' HG22 ' A' ' 128' ' ' THR . 12.6 t70 -75.36 161.75 28.99 Favored 'General case' 0 C--O 1.252 1.197 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? 76.92 -65.81 0.27 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.78 1.632 . . . . 0.0 111.107 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -146.14 149.18 33.51 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -86.62 56.99 4.25 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 59.7 -101.09 0.11 Allowed 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.466 1.507 . . . . 0.0 111.913 -173.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -162.6 162.87 27.35 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -179.6 -39.7 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.58 1.175 . . . . 0.0 108.064 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.8 t70 66.66 78.26 0.26 Allowed 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.854 -1.535 . . . . 0.0 106.854 -170.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.8 mtt -80.75 75.97 7.66 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.781 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.6 m -100.48 -46.22 5.29 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.66 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.9 pp -98.86 -18.93 17.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.454 0.645 . . . . 0.0 111.242 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 C--N 1.307 -1.259 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.706 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 N--CA 1.437 -1.088 0 CA-C-O 120.908 0.385 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -99.53 83.04 2.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.016 0.436 . . . . 0.0 111.632 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.44 48.52 21.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.781 0.832 . . . . 0.0 110.203 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mm -74.27 113.97 13.39 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.781 -176.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.72 106.12 12.48 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.11 19.22 15.84 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.42 0.629 . . . . 0.0 111.837 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.8 m -121.96 97.29 5.42 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -83.55 112.18 19.76 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.792 0.806 . . . . 0.0 110.935 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -128.1 127.61 43.37 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -83.11 148.98 57.85 Favored Pre-proline 0 C--N 1.294 -1.82 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -85.75 -171.52 0.91 Allowed 'Trans proline' 0 N--CA 1.444 -1.425 0 C-N-CA 122.438 2.092 . . . . 0.0 111.072 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.94 -175.02 4.88 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.975 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.63 132.08 6.61 Favored Glycine 0 N--CA 1.414 -2.777 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.54 123.85 14.83 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 123.019 2.48 . . . . 0.0 112.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 74.76 129.7 0.04 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 126.086 1.754 . . . . 0.0 112.826 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.17 63.44 4.48 Favored Glycine 0 C--N 1.316 -0.569 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.55 95.14 0.14 Allowed Glycine 0 N--CA 1.431 -1.666 0 N-CA-C 107.449 -2.261 . . . . 0.0 107.449 -175.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -98.65 109.49 22.24 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.273 0.559 . . . . 0.0 111.112 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.77 147.72 24.61 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t 68.55 105.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.208 0 O-C-N 124.063 0.852 . . . . 0.0 109.261 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 25' ' ' VAL . 19.6 t70 -70.71 108.97 4.66 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.086 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD23 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.488 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.444 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.408 HD21 HD11 ' A' ' 54' ' ' LEU . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.548 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.567 HD13 ' HB3' ' A' ' 41' ' ' GLN . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HB2' HG12 ' A' ' 61' ' ' ILE . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.646 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.408 ' CE2' HD22 ' A' ' 74' ' ' LEU . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 70' ' ' PHE . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.472 HD12 HD22 ' A' ' 89' ' ' LEU . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.67 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.422 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.67 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.434 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.434 HG12 ' HA ' ' A' ' 97' ' ' ALA . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 115' ' ' MET . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 118' ' ' ASN . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.7 mmm -67.45 -50.47 59.1 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 25' ' ' VAL 0.259 0.8 OUTLIER -72.47 -32.05 65.92 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -176.615 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -82.24 -24.85 34.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' ALA . 12.4 m-80 -95.36 -54.03 3.55 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.4 -76.01 0.08 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.097 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.8 pttm 36.57 77.95 0.37 Allowed Pre-proline 0 CA--C 1.558 1.252 0 C-N-CA 124.589 1.156 . . . . 0.0 112.079 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.78 -36.71 63.43 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.734 2.956 . . . . 0.0 114.67 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.51 -29.86 68.55 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.95 56.33 1.95 Allowed 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.571 1.177 . . . . 0.0 109.335 -175.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -143.65 83.18 1.75 Allowed 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 104.156 -2.535 . . . . 0.0 104.156 169.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.81 -23.94 25.18 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.102 -1.863 . . . . 0.0 112.483 -168.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.87 3.41 Favored Glycine 0 N--CA 1.432 -1.592 0 C-N-CA 119.641 -1.266 . . . . 0.0 112.702 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -96.7 -79.85 0.44 Allowed 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 23.6 m 57.91 -66.69 0.03 OUTLIER 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.858 1.663 . . . . 0.0 114.013 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm 58.87 27.59 16.36 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.377 1.471 . . . . 0.0 112.266 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -154.86 107.26 2.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.123 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -103.47 -31.82 9.79 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.078 178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 133' ' ' ASP . 9.0 tptm 56.39 -171.22 0.08 Allowed 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.032 1.333 . . . . 0.0 110.686 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.4 ' H ' ' HG3' ' A' ' 132' ' ' LYS . 17.4 t70 -159.0 -43.53 0.06 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 77.57 125.13 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.716 1.206 . . . . 0.0 113.984 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.99 116.41 32.64 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -137.05 0.33 2.36 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 62.9 t0 51.35 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.584 1.153 . . . . 0.0 110.692 -169.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 27.6 ttt -72.6 -15.79 61.74 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.811 -175.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 m -101.43 6.05 42.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.739 -178.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 5.6 tt -64.97 -52.61 55.29 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.195 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.8 m120 69.63 159.8 0.19 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 175.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.66 88.66 2.15 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.05 92.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-O 121.79 0.805 . . . . 0.0 110.114 -173.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 tt 171.38 -32.63 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 103.113 -2.921 . . . . 0.0 103.113 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 73.4 -79.24 0.04 OUTLIER 'General case' 0 C--N 1.349 0.571 0 CA-C-N 113.364 -1.744 . . . . 0.0 111.336 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -150.13 125.0 9.85 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -83.96 -39.9 19.16 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.579 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 10.3 t30 69.35 159.25 0.18 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.915 175.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -97.25 92.19 1.16 Allowed Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 121.724 0.773 . . . . 0.0 109.168 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 2.0 Cg_endo -82.65 -60.05 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.273 1.982 . . . . 0.0 115.008 -173.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 66.65 26.31 9.71 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.969 0.908 . . . . 0.0 108.919 -170.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.88 125.27 8.18 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.938 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -102.65 19.81 0.19 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.875 2.384 . . . . 0.0 111.829 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.2 -175.82 0.2 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.512 1.125 . . . . 0.0 110.616 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -169.29 174.37 43.7 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.07 75.81 0.06 OUTLIER Glycine 0 C--N 1.306 -1.086 0 C-N-CA 120.703 -0.761 . . . . 0.0 111.366 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -88.21 146.46 25.35 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 20.1 tm0? 71.84 -41.32 0.5 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.684 1.594 . . . . 0.0 113.754 173.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 t -93.49 127.59 45.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -86.77 96.82 10.31 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.453 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.48 ' O ' HD13 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.48 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 54' ' ' LEU . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.521 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.549 HD13 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.408 HG23 HD12 ' A' ' 65' ' ' LEU . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.408 HD12 HG23 ' A' ' 61' ' ' ILE . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.515 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.521 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.416 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 77' ' ' PHE . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.641 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HB2' HD13 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.475 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm -60.92 -57.8 11.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.259 0.7 OUTLIER -71.54 -16.9 62.34 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -176.356 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -78.5 -41.81 31.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.303 175.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -79.99 -43.48 21.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.921 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.99 66.84 7.75 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.211 1.005 . . . . 0.0 108.339 173.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -59.39 131.48 87.89 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 113.228 -1.805 . . . . 0.0 109.37 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.51 76.82 0.52 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.645 2.23 . . . . 0.0 112.714 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 179.23 -39.57 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 127.197 2.199 . . . . 0.0 106.189 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 50.0 86.1 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.166 1.787 . . . . 0.0 112.674 176.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -151.63 119.78 6.3 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.451 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -103.03 136.39 42.94 Favored 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.361 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.88 77.75 1.09 Allowed Glycine 0 N--CA 1.432 -1.585 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.112 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -100.75 111.51 23.74 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 13.2 t -91.9 144.38 25.54 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.061 0.458 . . . . 0.0 110.987 -174.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -79.18 105.44 10.51 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.306 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 132' ' ' LYS . 34.1 t70 -111.05 124.74 52.78 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.781 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.567 ' HD2' ' N ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -76.92 -35.35 57.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.772 0.32 . . . . 0.0 111.656 -179.484 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LYS . . . . . 0.567 ' N ' ' HD2' ' A' ' 131' ' ' LYS . 17.2 ttmm 59.43 -83.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.289 1.435 . . . . 0.0 114.239 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 134' ' ' GLU . 6.7 p-10 -85.71 -95.36 0.08 Allowed 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 123.679 0.792 . . . . 0.0 111.987 -173.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLU . . . . . 0.423 ' H ' ' CG ' ' A' ' 133' ' ' ASP . 36.9 mt-10 -99.84 136.67 39.41 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -103.86 116.01 31.5 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.618 0.723 . . . . 0.0 111.219 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -122.65 130.01 52.49 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.332 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -87.51 151.64 22.85 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.78 -30.51 67.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.124 0.488 . . . . 0.0 111.109 178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.8 m -96.93 9.95 40.51 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.15 -0.344 . . . . 0.0 111.546 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 60.4 tp -84.28 -53.99 5.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.024 0.44 . . . . 0.0 110.305 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.597 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -144.29 153.3 41.87 Favored 'General case' 0 CA--C 1.502 -0.896 0 O-C-N 122.071 -0.393 . . . . 0.0 111.065 -176.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.18 79.94 1.8 Allowed 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.2 mt -81.67 79.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 122.085 0.945 . . . . 0.0 109.944 -174.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.0 mt -104.16 84.16 2.19 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.654 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.7 72.98 0.18 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.86 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.9 t -81.38 -24.41 37.02 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -142.98 140.06 30.9 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -86.4 73.85 10.06 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.279 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.2 m -111.76 122.83 36.14 Favored Pre-proline 0 N--CA 1.424 -1.774 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.688 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.79 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.183 1.922 . . . . 0.0 111.73 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.52 141.06 23.39 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.25 80.83 0.32 Allowed Glycine 0 C--N 1.289 -2.05 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.598 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -91.21 16.19 1.61 Allowed 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 122.545 2.163 . . . . 0.0 111.407 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.6 -66.02 0.28 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.428 1.491 . . . . 0.0 112.704 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.63 -127.64 5.87 Favored Glycine 0 N--CA 1.432 -1.631 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -119.28 133.48 10.15 Favored Glycine 0 C--N 1.302 -1.353 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -88.65 -23.97 22.9 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.033 0.444 . . . . 0.0 111.314 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -89.81 -72.58 0.55 Allowed 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.2 t -117.12 111.05 33.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.0 t70 -76.42 116.57 17.23 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.713 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG13 ' A' ' 25' ' ' VAL . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.601 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.601 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.478 HG21 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.563 ' SD ' HD13 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.482 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.444 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.483 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.656 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.656 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 0.5 OUTLIER -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.516 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 HG12 ' A' ' 108' ' ' VAL . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.484 HD11 ' HB ' ' A' ' 40' ' ' VAL . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.501 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' ' 95' ' ' LEU . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.408 HG12 HD22 ' A' ' 81' ' ' LEU . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.478 ' SD ' HG21 ' A' ' 30' ' ' ILE . 48.2 ttm -66.08 -59.43 3.8 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.261 3.7 pp0? -72.06 -24.71 61.56 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 119.168 -1.013 . . . . 0.0 112.867 -176.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -70.24 -42.5 72.13 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.257 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -104.93 -27.29 11.79 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -173.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.73 65.56 7.92 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -172.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.74 125.07 0.27 Allowed Pre-proline 0 C--N 1.307 -1.267 0 C-N-CA 125.418 1.487 . . . . 0.0 107.805 170.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -92.48 7.74 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.446 2.098 . . . . 0.0 112.096 -177.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -82.73 -8.86 59.56 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -174.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.5 tm0? -66.45 120.81 14.0 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -148.17 168.24 22.97 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.058 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -166.98 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.08 25.68 12.46 Favored Glycine 0 N--CA 1.441 -1.004 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.043 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -88.28 96.61 10.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.559 0.695 . . . . 0.0 109.39 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 5.0 m -118.0 -13.7 10.01 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.377 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.474 ' C ' ' H ' ' A' ' 131' ' ' LYS . 3.6 mptp? 63.04 35.69 12.9 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.703 0.763 . . . . 0.0 110.025 -174.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -79.85 27.59 0.3 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.565 1.146 . . . . 0.0 110.063 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.474 ' H ' ' C ' ' A' ' 129' ' ' LYS . 38.0 ttpt -87.74 129.14 35.26 Favored 'General case' 0 N--CA 1.423 -1.795 0 CA-C-N 114.209 -1.36 . . . . 0.0 109.265 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -137.68 140.34 40.74 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 63.59 -115.19 0.44 Allowed 'General case' 0 C--O 1.243 0.732 0 O-C-N 123.801 0.688 . . . . 0.0 109.319 -177.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 66.68 -65.79 0.2 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.166 1.386 . . . . 0.0 112.663 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 41.8 tt0 -166.94 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -172.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 135' ' ' GLU . 12.7 pt-20 63.9 -0.12 0.85 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 127.541 2.336 . . . . 0.0 114.47 174.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 27.1 t70 61.65 92.77 0.05 Allowed 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.823 1.249 . . . . 0.0 111.342 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.6 ttt -104.13 89.68 3.35 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.569 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -62.22 -39.49 92.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.571 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -144.63 -63.17 0.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.6 t70 . . . . . 0 C--N 1.307 -1.272 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.642 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.705 ' HB3' ' HB2' ' A' ' 38' ' ' ALA . 31.0 p-10 -71.23 111.15 6.34 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.816 1.293 . . . . 0.0 113.441 -177.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.34 34.13 1.07 Allowed 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 173.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.1 mt -49.19 119.26 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.049 -170.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.7 mt -86.97 139.93 30.1 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.789 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.49 92.3 9.04 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 105.912 -1.884 . . . . 0.0 105.912 171.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -66.3 -30.22 70.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.774 0.797 . . . . 0.0 109.534 -175.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.43 145.95 2.73 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 172.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.545 ' OD1' ' HA ' ' A' ' 50' ' ' SER . 18.4 t-20 -134.87 72.08 1.45 Allowed 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 118.636 -1.226 . . . . 0.0 111.642 -178.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 42.3 t -138.95 71.68 41.45 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -96.19 -18.01 0.3 Allowed 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.992 1.794 . . . . 0.0 114.107 -177.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.59 72.57 0.51 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.06 0.944 . . . . 0.0 110.574 -171.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.489 ' HA3' ' HA ' ' A' ' 47' ' ' TYR . . . -105.1 105.59 2.54 Favored Glycine 0 N--CA 1.429 -1.782 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.664 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -95.67 168.64 1.34 Allowed 'Trans proline' 0 N--CA 1.437 -1.8 0 C-N-CA 122.751 2.301 . . . . 0.0 112.008 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.14 91.33 5.22 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.86 -53.83 40.1 Favored Glycine 0 CA--C 1.504 -0.627 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.339 -178.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.72 125.55 8.19 Favored Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -156.82 102.27 2.01 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.428 0.633 . . . . 0.0 110.464 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 20' ' ' VAL . 52.3 tt0 -145.55 144.94 30.81 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 176.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' A' ' 19' ' ' GLN . 77.6 t 73.61 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 O-C-N 124.469 1.106 . . . . 0.0 109.43 -172.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.405 ' O ' HG12 ' A' ' 25' ' ' VAL . 38.1 t70 -76.49 94.14 3.65 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.279 -0.888 . . . . 0.0 109.082 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.48 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.447 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.422 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.705 ' HB2' ' HB3' ' A' ' 2' ' ' ASN . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.647 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HA ' ' HA3' ' A' ' 13' ' ' GLY . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.545 ' HA ' ' OD1' ' A' ' 9' ' ' ASN . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.428 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 61' ' ' ILE . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.405 HD23 HD13 ' A' ' 22' ' ' LEU . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.679 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 89' ' ' LEU . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.549 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.46 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' CYS . . . . . 0.494 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.422 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm -61.22 -55.06 36.42 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.48 ' HG2' HG23 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.85 -30.28 68.77 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -176.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -74.91 -34.92 62.23 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.923 0.392 . . . . 0.0 111.897 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -96.85 -56.2 2.64 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -173.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -169.93 108.31 0.38 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -171.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -127.58 85.78 60.02 Favored Pre-proline 0 C--N 1.302 -1.48 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -103.05 25.85 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 123.128 2.552 . . . . 0.0 113.261 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -73.13 -47.08 47.19 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -172.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -91.91 107.12 18.98 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -116.1 81.18 1.56 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.204 0.526 . . . . 0.0 111.976 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.02 97.45 3.02 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 174.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 153.74 40.93 0.02 OUTLIER Glycine 0 C--N 1.283 -2.37 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -64.15 110.55 2.22 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.17 -1.015 . . . . 0.0 109.702 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 10.4 m -117.73 97.98 6.13 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.265 0.555 . . . . 0.0 110.252 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.47 -9.81 46.04 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.655 0.741 . . . . 0.0 109.692 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -89.54 129.77 35.96 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.668 -174.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -95.77 -53.51 3.67 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.213 -175.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -148.38 138.49 22.5 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -95.44 139.98 30.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -99.35 15.3 26.73 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.913 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -80.69 -36.08 32.77 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.51 109.22 7.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 172.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.0 133.03 39.22 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.5 ptm -129.62 25.61 5.37 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.3 m -83.27 -53.74 5.53 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.461 HD23 ' H ' ' A' ' 140' ' ' LEU . 1.3 pt? -107.95 74.07 0.93 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-O 121.993 0.902 . . . . 0.0 108.975 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.304 -1.38 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.53 -177.99 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -103.08 -165.11 1.14 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 81.46 34.52 0.1 Allowed 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.536 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.3 mp -85.44 81.57 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 174.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -104.71 117.28 33.69 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.013 -172.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.9 86.37 2.23 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 9' ' ' ASN . 15.1 t -108.8 -28.82 8.98 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.483 -174.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.6 ptt? 54.33 24.17 4.91 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.269 1.428 . . . . 0.0 113.243 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.509 ' H ' HG23 ' A' ' 7' ' ' THR . 78.0 m-20 -84.37 111.62 19.6 Favored 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.742 178.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -152.16 95.15 3.19 Favored Pre-proline 0 C--N 1.292 -1.929 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -95.83 -174.32 0.28 Allowed 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.423 2.082 . . . . 0.0 112.017 -178.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.15 76.43 4.63 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 175.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.62 118.3 4.97 Favored Glycine 0 N--CA 1.425 -2.067 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.347 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -76.6 93.69 1.05 Allowed 'Trans proline' 0 N--CA 1.444 -1.411 0 C-N-CA 122.234 1.956 . . . . 0.0 110.156 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.51 174.03 11.29 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.75 33.13 0.88 Allowed Glycine 0 C--N 1.3 -1.467 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -176.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.59 28.94 3.55 Favored Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.892 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -141.59 158.09 44.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 117.187 0.494 . . . . 0.0 110.058 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 62.64 30.77 16.96 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.983 1.313 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.452 HG21 ' HG2' ' A' ' 109' ' ' GLU . 61.5 t 60.27 80.11 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -171.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.9 t70 -67.05 97.61 0.52 Allowed 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.128 -174.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.427 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 25' ' ' VAL . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.457 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 2.2 t-20 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.546 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.414 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 41' ' ' GLN . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.642 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 13.6 mm100 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.642 ' OD1' ' HA ' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 22' ' ' LEU . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD12 HD22 ' A' ' 89' ' ' LEU . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.468 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HA ' HE21 ' A' ' 92' ' ' GLN . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 89' ' ' LEU . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.468 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.414 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.452 ' HG2' HG21 ' A' ' 20' ' ' VAL . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.531 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp -75.63 -45.63 36.22 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.32 0.0 OUTLIER -82.96 -7.42 59.67 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -98.0 -12.49 21.89 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.772 173.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -123.29 -57.52 1.67 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.3 -38.72 68.65 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -172.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 8.8 ptpt -136.45 80.51 38.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-O 121.038 0.447 . . . . 0.0 111.559 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -81.85 -0.7 10.5 Favored 'Trans proline' 0 C--O 1.253 1.256 0 C-N-CA 122.587 2.192 . . . . 0.0 111.614 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 64.4 -168.28 0.21 Allowed 'General case' 0 C--O 1.254 1.305 0 C-N-CA 124.654 1.181 . . . . 0.0 110.065 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -83.14 84.84 7.33 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 119.756 -0.777 . . . . 0.0 108.997 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -84.43 39.3 0.72 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.214 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -93.0 -17.7 23.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.844 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.22 46.95 3.44 Favored Glycine 0 C--O 1.243 0.704 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -164.99 140.14 5.29 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t -118.0 149.77 40.39 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -68.54 -53.86 20.39 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 106.185 -1.783 . . . . 0.0 106.185 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.3 p30 172.8 -179.21 0.08 Allowed 'General case' 0 CA--C 1.499 -1.005 0 C-N-CA 126.641 1.976 . . . . 0.0 107.868 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -143.66 172.91 12.16 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.234 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -78.24 123.41 26.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.427 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -141.55 106.65 4.96 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 123.623 0.577 . . . . 0.0 109.622 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -139.29 104.21 4.93 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.803 0.811 . . . . 0.0 110.84 177.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -115.95 -67.67 0.98 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -108.59 -59.93 1.81 Allowed 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 173.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.9 t70 62.4 11.71 4.8 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 125.053 1.341 . . . . 0.0 113.277 169.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . 0.296 23.8 ptt? 48.76 -167.45 0.02 OUTLIER 'General case' 0 C--O 1.245 0.857 0 C-N-CA 124.989 1.316 . . . . 0.0 113.499 -174.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m 70.75 16.55 6.71 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.561 0.744 . . . . 0.0 111.462 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -109.73 -37.51 5.64 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--N 1.308 -1.203 0 C-N-CA 126.314 1.846 . . . . 0.0 106.995 173.986 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.437 -1.092 0 CA-C-O 121.155 0.502 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -121.8 114.95 21.79 Favored 'General case' 0 CA--C 1.483 -1.605 0 CA-C-O 120.811 0.339 . . . . 0.0 110.231 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.15 94.41 4.08 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 173.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.2 mm -97.66 126.05 50.67 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.839 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 tt -82.52 95.4 7.72 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.05 121.11 43.47 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.2 m 70.24 99.84 0.06 Allowed 'General case' 0 C--N 1.314 -0.954 0 O-C-N 124.413 1.071 . . . . 0.0 112.378 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -93.48 22.62 5.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.937 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 77.17 146.26 0.09 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.936 1.694 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t 67.44 80.32 0.22 Allowed Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.442 1.097 . . . . 0.0 111.717 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.34 -31.63 27.87 Favored 'Trans proline' 0 C--O 1.249 1.064 0 C-N-CA 122.43 2.087 . . . . 0.0 110.916 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 73.67 141.26 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.711 1.604 . . . . 0.0 112.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.05 77.68 1.13 Allowed Glycine 0 N--CA 1.437 -1.26 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.563 -178.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.2 -34.44 36.33 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.875 2.383 . . . . 0.0 113.746 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.7 -48.66 1.52 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 120.999 0.428 . . . . 0.0 110.8 -178.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 143.62 -96.02 0.19 Allowed Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 67.56 36.93 89.1 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 178.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -94.07 110.25 21.96 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -76.2 -55.28 5.72 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 173.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t -95.1 75.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.42 -1.939 0 CA-C-O 122.214 1.006 . . . . 0.0 109.055 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -85.75 109.11 18.41 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 175.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.46 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.46 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.51 ' ND2' ' HB3' ' A' ' 39' ' ' ASP . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.51 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.586 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.53 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD12 HG23 ' A' ' 61' ' ' ILE . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.529 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.529 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.426 ' HB2' HG23 ' A' ' 100' ' ' VAL . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.572 ' HB2' HD13 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.454 ' CG ' ' HB2' ' A' ' 118' ' ' ASN . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.45 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.49 ' HG2' ' HB1' ' A' ' 114' ' ' ALA . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 97' ' ' ALA . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HA ' ' HE2' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.49 ' HB1' ' HG2' ' A' ' 98' ' ' GLU . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.582 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.94 -58.76 6.24 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.265 0.0 OUTLIER -70.12 -16.39 63.11 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.184 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -80.16 -24.29 40.51 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.454 ' HB2' ' CG ' ' A' ' 96' ' ' PRO . 41.7 m-80 -128.79 16.68 6.33 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.697 -175.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.24 -48.17 58.12 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.048 0.451 . . . . 0.0 110.853 -177.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -114.89 97.96 48.87 Favored Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -93.29 21.91 0.61 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.53 2.153 . . . . 0.0 111.737 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -104.52 119.58 39.3 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.739 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -96.47 -35.06 11.27 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.549 172.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 61.97 18.93 10.33 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.039 1.336 . . . . 0.0 111.087 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -102.69 -27.29 12.8 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 100.5 -150.76 18.91 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -155.41 103.86 2.35 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.38 0.59 . . . . 0.0 111.133 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 95.0 m -90.29 126.66 35.92 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.44 ' N ' ' HD2' ' A' ' 129' ' ' LYS . 3.7 mptp? -73.71 -63.73 1.14 Allowed 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.81 -177.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -117.32 -88.21 0.6 Allowed 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.571 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -156.63 170.58 22.08 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 14.81 2.28 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 124.013 0.82 . . . . 0.0 109.755 174.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -108.3 141.32 40.26 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.47 135.25 38.24 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.111 0.481 . . . . 0.0 110.85 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -107.3 -179.38 3.91 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.84 -22.13 37.17 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.337 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.4 t70 55.99 67.61 0.98 Allowed 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.154 -177.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 88.3 mtp 65.43 -78.11 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 113.605 -1.634 . . . . 0.0 112.321 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 12.4 p 51.13 35.43 13.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.519 1.152 . . . . 0.0 111.021 -174.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -106.66 -54.36 2.48 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 113.954 -1.475 . . . . 0.0 108.388 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.841 -178.518 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -90.14 131.18 36.12 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 120.926 0.393 . . . . 0.0 110.688 -177.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.4 93.91 2.44 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.076 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.12 92.36 2.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 177.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -93.86 127.13 39.45 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.33 105.39 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.0 m -91.35 45.51 1.24 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.853 1.311 . . . . 0.0 111.0 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -162.76 95.11 0.88 Allowed 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.751 -3.055 . . . . 0.0 102.751 173.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -150.16 177.35 9.99 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.486 -171.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -112.62 101.2 52.32 Favored Pre-proline 0 N--CA 1.433 -1.283 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -55.94 -40.8 82.86 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.947 2.431 . . . . 0.0 112.854 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.09 60.51 3.4 Favored 'General case' 0 C--O 1.247 0.935 0 O-C-N 124.261 0.976 . . . . 0.0 109.669 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.43 ' HA2' ' HD3' ' A' ' 14' ' ' PRO . . . -82.31 136.09 15.09 Favored Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.953 -178.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD3' ' HA2' ' A' ' 13' ' ' GLY . 25.2 Cg_exo -68.38 27.83 0.14 Allowed 'Trans proline' 0 CA--C 1.554 1.491 0 C-N-CA 124.046 3.164 . . . . 0.0 114.266 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.49 153.19 40.43 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.357 0.663 . . . . 0.0 109.344 177.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 158.87 -160.29 31.0 Favored Glycine 0 N--CA 1.426 -2.009 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.396 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.25 51.55 4.51 Favored Glycine 0 C--N 1.31 -0.891 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -89.8 130.0 36.11 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.96 -37.88 58.14 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 119.57 -0.852 . . . . 0.0 109.171 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.06 73.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 172.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.2 t70 -83.7 109.19 17.28 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.213 -1.358 . . . . 0.0 107.806 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.452 HD13 HD23 ' A' ' 74' ' ' LEU . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.517 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.449 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 HD13 ' A' ' 22' ' ' LEU . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.504 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HB2' HD13 ' A' ' 95' ' ' LEU . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.504 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.485 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LYS . . . . . 0.548 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.485 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm -63.53 -54.72 31.83 Favored 'General case' 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.333 3.0 pp0? -76.8 -8.93 58.25 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 118.525 -1.27 . . . . 0.0 114.254 179.323 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.87 -19.72 47.61 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.596 174.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -130.88 -45.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -100.29 15.13 28.65 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 116' ' ' GLN . 63.0 tttm -87.09 116.1 64.93 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 176.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 120' ' ' LYS . 2.7 Cg_exo -73.77 75.91 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.522 2.148 . . . . 0.0 113.007 -174.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -91.11 98.54 11.81 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.945 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 65.59 -73.63 0.06 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.643 1.577 . . . . 0.0 112.13 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . 0.37 32.2 mttp 47.84 65.43 1.3 Allowed 'General case' 0 CA--C 1.493 -1.25 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.91 71.57 0.42 Allowed 'General case' 0 N--CA 1.421 -1.912 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 175.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -137.62 73.88 0.42 Allowed Glycine 0 N--CA 1.42 -2.372 0 N-CA-C 107.303 -2.319 . . . . 0.0 107.303 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -78.55 178.89 7.43 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 114.557 -0.821 . . . . 0.0 109.369 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -97.13 111.79 23.87 Favored 'General case' 0 N--CA 1.427 -1.58 0 O-C-N 121.792 -0.567 . . . . 0.0 110.92 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -123.24 83.36 2.12 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 122.031 0.92 . . . . 0.0 110.028 176.286 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -93.12 -23.24 18.67 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.475 -1.238 . . . . 0.0 111.005 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -84.58 111.5 19.58 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -138.06 178.09 7.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -174.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -66.5 -30.87 71.3 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 170.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -81.38 90.72 6.19 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -117.89 -54.15 2.35 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.795 -175.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -102.88 145.95 29.04 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -100.56 124.33 45.98 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 13.9 tpt -78.63 80.46 5.0 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.904 0.859 . . . . 0.0 110.107 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 2.1 m -77.45 -29.66 52.9 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.823 -178.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.3 mp -58.98 -53.44 58.41 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.965 -177.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 CA--C 1.487 -1.461 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.821 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.243 0.719 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -121.12 141.69 50.56 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.2 97.02 6.88 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 pt -115.68 -11.42 11.97 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.94 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt 69.58 -64.87 0.33 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.053 1.341 . . . . 0.0 110.141 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 174.4 -33.05 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 127.05 2.14 . . . . 0.0 105.558 -177.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 m 72.82 -56.12 0.66 Allowed 'General case' 0 C--N 1.351 0.673 0 CA-C-N 113.749 -1.569 . . . . 0.0 111.567 176.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.532 ' SD ' ' HG3' ' A' ' 46' ' ' PRO . 20.4 ptm -130.87 103.19 6.42 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 121.6 0.714 . . . . 0.0 110.398 -178.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -80.69 104.83 11.48 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.163 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -138.29 134.99 17.93 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.696 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -66.2 -45.89 5.06 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 121.98 1.787 . . . . 0.0 109.157 170.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.44 -167.05 0.13 Allowed 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.947 1.299 . . . . 0.0 112.902 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -139.57 76.57 0.33 Allowed Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 174.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.8 -46.66 10.49 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.062 2.508 . . . . 0.0 114.198 -177.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 122.22 22.06 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.867 0.365 . . . . 0.0 110.775 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.3 110.78 0.46 Allowed Glycine 0 N--CA 1.429 -1.816 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.87 -114.52 5.35 Favored Glycine 0 C--N 1.312 -0.785 0 C-N-CA 121.073 -0.584 . . . . 0.0 112.006 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 70.58 103.23 0.06 Allowed 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.41 1.484 . . . . 0.0 113.24 178.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -108.53 159.07 16.99 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 175.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.5 t 69.47 125.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 124.334 1.021 . . . . 0.0 110.848 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.402 ' O ' HG12 ' A' ' 25' ' ' VAL . 13.0 t70 -70.55 104.35 2.76 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 -176.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.509 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' HB3' HD13 ' A' ' 54' ' ' LEU . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' ' SD ' ' A' ' 8' ' ' MET . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.498 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 41' ' ' GLN . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.443 HD12 HG23 ' A' ' 61' ' ' ILE . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.477 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.498 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.46 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.406 HD22 HG12 ' A' ' 108' ' ' VAL . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.674 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.674 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 118' ' ' ASN . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 97' ' ' ALA . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.406 HG12 HD22 ' A' ' 81' ' ' LEU . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm -69.51 -40.42 76.97 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.474 ' HG2' HG23 ' A' ' 25' ' ' VAL 0.257 0.8 OUTLIER -74.24 -22.73 59.21 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.398 -0.921 . . . . 0.0 113.055 179.617 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -83.94 -39.06 20.24 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.863 0.363 . . . . 0.0 111.577 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.472 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . 46.6 m-80 -99.04 -46.72 5.49 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.93 7.62 17.66 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.423 0.63 . . . . 0.0 111.778 -172.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -111.76 92.76 18.16 Favored Pre-proline 0 C--N 1.293 -1.873 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.89 -43.89 14.73 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 122.784 2.323 . . . . 0.0 114.083 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 68.21 171.27 0.28 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.359 1.064 . . . . 0.0 111.992 -177.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -146.54 -56.7 0.27 Allowed 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.25 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt 40.25 74.96 0.09 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.45 1.5 . . . . 0.0 114.582 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.09 0.12 29.27 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.241 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -73.82 57.85 2.18 Favored Glycine 0 N--CA 1.464 0.525 0 CA-C-O 121.698 0.61 . . . . 0.0 111.681 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -141.65 -65.75 0.42 Allowed 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -177.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' THR . . . . . 0.516 HG22 ' H ' ' A' ' 130' ' ' ASP . 9.1 m 67.96 149.58 0.06 Allowed 'General case' 0 CA--C 1.571 1.755 0 C-N-CA 124.234 1.014 . . . . 0.0 112.458 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -70.27 -23.24 62.85 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.738 0.78 . . . . 0.0 109.938 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' ASP . . . . . 0.516 ' H ' HG22 ' A' ' 128' ' ' THR . 9.5 m-20 -78.93 140.44 38.06 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.221 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 50.8 tptt 68.87 31.06 4.46 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 124.708 1.255 . . . . 0.0 108.576 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -124.49 -53.58 1.69 Allowed 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.15 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -97.43 -73.41 0.61 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -172.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -82.93 102.26 11.58 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -166.16 82.81 0.29 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -93.56 110.38 21.98 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.31 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -126.12 132.26 51.9 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 67.2 mtt -93.72 -42.19 9.28 Favored 'General case' 0 C--N 1.286 -2.186 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.579 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 50.4 m 53.23 40.35 31.13 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.931 0.769 . . . . 0.0 111.022 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 67.51 89.02 0.1 Allowed 'General case' 0 C--O 1.249 1.034 0 C-N-CA 124.526 1.131 . . . . 0.0 110.398 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.301 -1.509 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.286 -178.077 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -102.01 85.63 2.72 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.45 85.03 6.79 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -169.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.2 mp -108.84 -68.03 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 168.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.513 HD13 ' O ' ' A' ' 5' ' ' LEU . 2.9 tm? -117.43 -14.52 10.34 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.53 128.81 39.05 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.8 t -137.56 -170.55 2.78 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -82.34 -17.28 46.24 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 120.699 0.285 . . . . 0.0 111.101 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -116.55 156.29 27.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.134 0.492 . . . . 0.0 111.412 -174.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.6 t -137.84 122.37 12.07 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -64.18 -45.79 9.24 Favored 'Trans proline' 0 C--O 1.25 1.123 0 C-N-CA 122.588 2.192 . . . . 0.0 112.001 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.72 -162.59 0.27 Allowed 'General case' 0 C--O 1.249 1.038 0 O-C-N 124.054 0.846 . . . . 0.0 109.846 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.18 -166.67 38.9 Favored Glycine 0 N--CA 1.425 -2.052 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 178.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.62 139.32 82.77 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 123.181 2.587 . . . . 0.0 111.26 178.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.78 109.2 2.79 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.529 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.52 54.07 4.89 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -108.93 124.3 7.3 Favored Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.62 161.03 35.74 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -177.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -61.59 -43.32 99.07 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 111.176 -176.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.54 80.62 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 173.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 21.5 t70 -56.85 119.79 6.82 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.49 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.418 HD13 HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.494 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.483 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.516 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.596 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.416 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.465 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.447 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.544 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.544 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.418 HD23 HD13 ' A' ' 22' ' ' LEU . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.596 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.469 ' HB3' HG11 ' A' ' 108' ' ' VAL . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.428 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.401 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.401 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.53 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.469 HG11 ' HB3' ' A' ' 78' ' ' SER . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm -67.73 -55.45 13.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLN . . . . . 0.488 ' O ' ' HB2' ' A' ' 120' ' ' LYS 0.309 0.1 OUTLIER -71.93 -19.26 61.94 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.443 1.645 . . . . 0.0 115.443 -176.395 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.8 p30 -86.46 -32.65 20.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 119.884 -0.726 . . . . 0.0 112.33 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -85.89 -48.05 9.09 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.99 0.424 . . . . 0.0 110.843 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.85 66.29 9.54 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 116' ' ' GLN . 65.8 tttm -139.64 89.21 11.88 Favored Pre-proline 0 N--CA 1.424 -1.756 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.844 -174.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -71.91 -23.09 22.46 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.116 1.878 . . . . 0.0 109.87 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 120' ' ' LYS . 45.3 mt-10 -66.93 127.97 34.55 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.541 176.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -79.67 178.44 8.16 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.104 0.478 . . . . 0.0 110.73 -176.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.62 154.0 22.07 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -135.86 -54.35 0.77 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -171.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -147.03 46.8 0.71 Allowed Glycine 0 CA--C 1.473 -2.576 0 N-CA-C 108.846 -1.702 . . . . 0.0 108.846 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -130.39 125.49 34.68 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 114.289 -0.956 . . . . 0.0 110.699 -173.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 42.2 m -73.8 -55.6 6.02 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 79.8 tttt 57.03 27.51 13.41 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 122.238 1.018 . . . . 0.0 110.783 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -169.48 -164.09 0.43 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 103.957 -2.609 . . . . 0.0 103.957 -175.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -102.55 169.13 8.85 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -86.11 123.22 31.16 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 119.325 -0.95 . . . . 0.0 112.251 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.46 70.57 1.41 Allowed 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.862 -1.532 . . . . 0.0 106.862 172.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -153.17 175.44 13.04 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.313 -171.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 80.04 106.63 0.07 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 71.47 -46.76 0.65 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 166.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 67.77 31.91 5.62 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.142 0.977 . . . . 0.0 110.819 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.4 tpt 70.42 -41.62 0.5 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.137 1.375 . . . . 0.0 114.381 175.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m 72.9 -48.45 0.69 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.059 1.344 . . . . 0.0 112.249 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.27 25.47 1.38 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.999 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 176.773 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -142.51 92.54 2.43 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.48 135.03 12.53 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.131 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -97.66 84.16 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.8 tp -71.52 -23.5 61.79 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.461 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.27 68.51 0.67 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 124.051 0.941 . . . . 0.0 109.933 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.1 m -90.16 149.81 22.28 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.5 mpp? 68.92 93.18 0.08 Allowed 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 123.935 0.772 . . . . 0.0 108.922 -172.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -113.41 116.45 29.65 Favored 'General case' 0 C--N 1.292 -1.895 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.29 128.21 92.96 Favored Pre-proline 0 C--N 1.315 -0.919 0 O-C-N 123.433 0.458 . . . . 0.0 110.285 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.78 -28.89 5.96 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 121.984 1.789 . . . . 0.0 111.199 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.1 -163.42 0.26 Allowed 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.134 0.974 . . . . 0.0 109.951 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -124.08 75.9 0.38 Allowed Glycine 0 C--N 1.296 -1.694 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -88.75 79.72 1.01 Allowed 'Trans proline' 0 N--CA 1.432 -2.123 0 C-N-CA 122.361 2.041 . . . . 0.0 111.525 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.61 82.4 6.35 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.46 -56.36 3.5 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -176.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 116.64 -44.28 1.49 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 178.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -168.85 -77.18 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -170.44 -67.52 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.31 75.7 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 170.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 -85.11 128.33 34.61 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.289 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.438 ' HG ' HG13 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.487 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.559 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.559 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.517 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . 0.58 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.474 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.561 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 97' ' ' ALA . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.41 -56.12 21.26 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.12 -28.03 64.0 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -67.31 -47.86 69.32 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 120.958 0.409 . . . . 0.0 111.647 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -82.51 -35.25 27.53 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.166 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.36 36.13 27.01 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.377 1.071 . . . . 0.0 111.1 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' LYS . . . . . 0.602 ' O ' ' HD2' ' A' ' 120' ' ' LYS 0.356 0.1 OUTLIER 53.4 93.79 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 125.054 1.342 . . . . 0.0 112.819 -175.082 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' A' ' 124' ' ' LYS . 37.4 Cg_exo -61.29 -31.11 88.98 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.756 2.304 . . . . 0.0 112.946 -176.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 57.95 -81.54 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.393 1.077 . . . . 0.0 110.714 -172.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.85 100.01 6.97 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 121.672 0.749 . . . . 0.0 109.324 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 121' ' ' PRO . 50.8 mttp -139.98 43.88 1.93 Allowed 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 169.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -83.77 14.74 3.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 112.037 -2.347 . . . . 0.0 110.092 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.77 -31.03 2.89 Favored Glycine 0 C--N 1.3 -1.469 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.8 t70 70.66 112.29 0.05 Allowed 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 125.564 1.545 . . . . 0.0 112.631 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 39.4 m -80.19 88.83 5.45 Favored 'General case' 0 N--CA 1.416 -2.157 0 CA-C-O 121.695 0.76 . . . . 0.0 110.068 178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -96.82 -9.41 28.79 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -82.67 105.82 14.01 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.45 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -160.93 23.32 0.14 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -169.61 -55.45 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.854 1.262 . . . . 0.0 109.816 -175.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 63.73 67.69 0.62 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.774 -1.557 . . . . 0.0 109.513 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -131.81 65.14 1.58 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.072 -1.422 . . . . 0.0 107.851 175.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -89.07 99.34 12.35 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.209 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 73.57 120.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.821 1.325 . . . . 0.0 111.926 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.3 -35.05 61.33 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.774 178.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.2 ttt 57.35 65.53 1.34 Allowed 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.282 -178.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -68.55 -37.28 79.81 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.019 -173.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.0 mt -107.12 -68.05 0.91 Allowed 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -179.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 C--N 1.312 -1.037 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.954 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG12 ' A' ' 25' ' ' VAL . 31.3 t70 . . . . . 0 C--O 1.253 1.261 0 CA-C-O 120.707 0.289 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.404 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.404 ' HG ' HG13 ' A' ' 25' ' ' VAL . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.445 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD1' HD11 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.467 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 25.5 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 73' ' ' ALA . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.481 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.476 HD11 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.558 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.517 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.43 ' HB2' HG21 ' A' ' 100' ' ' VAL . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.43 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.481 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp . . . . . 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.515 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.6 t70 . . . . . 0 CA--C 1.496 -1.121 0 N-CA-C 110.741 -0.096 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.509 ' O ' HG22 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.579 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.66 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.579 HD13 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 61' ' ' ILE . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HA ' ' CG ' ' A' ' 63' ' ' ASN . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 57' ' ' THR . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.409 ' CG ' ' HA ' ' A' ' 60' ' ' GLU . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.4 ' C ' ' HB2' ' A' ' 70' ' ' PHE . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HB2' ' C ' ' A' ' 65' ' ' LEU . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.66 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB3' HG11 ' A' ' 108' ' ' VAL . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 108' ' ' VAL . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.404 HD11 ' HB ' ' A' ' 40' ' ' VAL . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.439 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.403 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 95' ' ' LEU . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 93' ' ' PHE . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.454 HG12 HD22 ' A' ' 81' ' ' LEU . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG12 ' A' ' 25' ' ' VAL . 7.6 t70 . . . . . 0 CA--C 1.486 -1.507 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 25' ' ' VAL . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.558 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.68 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.45 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.522 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.68 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 77' ' ' PHE . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.438 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.574 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.574 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.438 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 . . . . . 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.477 HG11 ' HB1' ' A' ' 112' ' ' ALA . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' HE22 ' A' ' 62' ' ' GLN . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.477 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.499 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 40' ' ' VAL . 32.9 t30 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.539 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.469 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.426 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.426 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.444 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 15.8 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.513 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.477 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.658 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.435 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 95' ' ' LEU . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.477 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.433 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.477 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 113' ' ' LYS . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm . . . . . 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.522 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 . . . . . 0 CA--C 1.485 -1.53 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.432 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.417 ' HG ' HG13 ' A' ' 25' ' ' VAL . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.53 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.478 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HB3' HD13 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.491 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.446 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.446 ' HD2' ' H ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.535 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HA ' HE21 ' A' ' 92' ' ' GLN . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.436 HE21 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.535 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm . . . . . 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.488 ' O ' HG12 ' A' ' 25' ' ' VAL . 12.0 t70 . . . . . 0 CA--C 1.489 -1.366 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.5 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG3' ' HB3' ' A' ' 55' ' ' PRO . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.48 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt . . . . . 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 . . . . . 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' HD21 ' A' ' 74' ' ' LEU . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 29' ' ' GLU . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.428 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.432 HD21 ' HB2' ' A' ' 26' ' ' LEU . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.46 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.424 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 58.3 tpp . . . . . 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.497 ' O ' HG12 ' A' ' 25' ' ' VAL . 28.3 t70 . . . . . 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.423 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.4 HD13 ' CE ' ' A' ' 31' ' ' MET . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.495 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.507 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.545 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.433 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.655 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.453 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.543 ' NE2' HE22 ' A' ' 72' ' ' GLN . 9.9 mm100 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.543 HE22 ' NE2' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.494 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.414 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.687 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.687 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.534 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp . . . . . 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.553 ' O ' HG12 ' A' ' 25' ' ' VAL . 6.5 t70 . . . . . 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.553 HG12 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' HG13 ' A' ' 25' ' ' VAL . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.436 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.565 ' O ' HG22 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.495 ' HB3' HD13 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HB2' HG12 ' A' ' 61' ' ' ILE . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.497 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.575 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.575 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 108' ' ' VAL . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.443 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.402 HG12 HD22 ' A' ' 81' ' ' LEU . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.409 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm . . . . . 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 CA--C 1.5 -0.965 0 CA-C-O 121.568 0.699 . . . . 0.0 109.856 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.505 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.518 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 61' ' ' ILE . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.492 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.512 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 42' ' ' GLU . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.512 HD13 ' HB3' ' A' ' 41' ' ' GLN . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HB2' HG12 ' A' ' 61' ' ' ILE . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.438 HG23 HD12 ' A' ' 65' ' ' LEU . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.404 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.404 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 81' ' ' LEU . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.518 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.676 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.544 ' HB2' HD13 ' A' ' 95' ' ' LEU . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.518 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt . . . . . 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 25' ' ' VAL . 19.6 t70 . . . . . 0 CA--C 1.494 -1.182 0 CA-C-O 120.982 0.42 . . . . 0.0 110.086 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD23 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.403 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.488 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.488 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.444 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.408 HD21 HD11 ' A' ' 54' ' ' LEU . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.548 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.466 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.567 HD13 ' HB3' ' A' ' 41' ' ' GLN . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HB2' HG12 ' A' ' 61' ' ' ILE . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.646 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.408 ' CE2' HD22 ' A' ' 74' ' ' LEU . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 70' ' ' PHE . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.472 HD12 HD22 ' A' ' 89' ' ' LEU . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.67 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.422 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.67 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.434 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.434 HG12 ' HA ' ' A' ' 97' ' ' ALA . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 115' ' ' MET . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.7 mmm . . . . . 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 . . . . . 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.453 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.48 ' O ' HD13 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.48 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 54' ' ' LEU . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.521 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.549 HD13 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.408 HG23 HD12 ' A' ' 65' ' ' LEU . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.408 HD12 HG23 ' A' ' 61' ' ' ILE . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.515 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.521 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.416 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 77' ' ' PHE . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.641 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HB2' HD13 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.475 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm . . . . . 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.0 t70 . . . . . 0 CA--C 1.486 -1.491 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG13 ' A' ' 25' ' ' VAL . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.601 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.601 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.478 HG21 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.563 ' SD ' HD13 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.482 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.444 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.483 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.808 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.808 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.1 p30 -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.516 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 HG12 ' A' ' 108' ' ' VAL . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.484 HD11 ' HB ' ' A' ' 40' ' ' VAL . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.501 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' ' 95' ' ' LEU . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.408 HG12 HD22 ' A' ' 81' ' ' LEU . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.478 ' SD ' HG21 ' A' ' 30' ' ' ILE . 48.2 ttm . . . . . 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.405 ' O ' HG12 ' A' ' 25' ' ' VAL . 38.1 t70 . . . . . 0 CA--C 1.5 -0.946 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.447 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.447 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.418 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.422 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.647 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.428 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 61' ' ' ILE . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.405 HD23 HD13 ' A' ' 22' ' ' LEU . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.679 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 89' ' ' LEU . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.549 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.46 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . 0.494 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.422 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm . . . . . 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.9 t70 . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.181 0.515 . . . . 0.0 110.128 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.427 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 25' ' ' VAL . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.457 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 30.1 t30 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.546 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.414 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 41' ' ' GLN . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.777 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 28.4 mm-40 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.777 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 9.2 p30 -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 22' ' ' LEU . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.44 HD12 HD22 ' A' ' 89' ' ' LEU . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.468 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HA ' HE21 ' A' ' 92' ' ' GLN . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 89' ' ' LEU . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.468 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.414 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.531 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 . . . . . 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.46 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.46 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.51 ' ND2' ' HB3' ' A' ' 39' ' ' ASP . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.51 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.586 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.53 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.416 HD12 HG23 ' A' ' 61' ' ' ILE . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.529 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.529 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.426 ' HB2' HG23 ' A' ' 100' ' ' VAL . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.572 ' HB2' HD13 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.45 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.49 ' HG2' ' HB1' ' A' ' 114' ' ' ALA . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 97' ' ' ALA . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HE2' ' HA ' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.49 ' HB1' ' HG2' ' A' ' 98' ' ' GLU . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.582 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.2 t70 . . . . . 0 CA--C 1.497 -1.087 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.452 HD13 HD23 ' A' ' 74' ' ' LEU . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.517 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.449 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 HD13 ' A' ' 22' ' ' LEU . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.504 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HB2' HD13 ' A' ' 95' ' ' LEU . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.504 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.485 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.485 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm . . . . . 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.402 ' O ' HG12 ' A' ' 25' ' ' VAL . 13.0 t70 . . . . . 0 CA--C 1.506 -0.727 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.509 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.443 ' HB3' HD13 ' A' ' 54' ' ' LEU . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.498 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 41' ' ' GLN . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.443 HD12 HG23 ' A' ' 61' ' ' ILE . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.477 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.498 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.46 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.406 HD22 HG12 ' A' ' 108' ' ' VAL . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.674 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.674 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 97' ' ' ALA . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.406 HG12 HD22 ' A' ' 81' ' ' LEU . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm . . . . . 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 21.5 t70 . . . . . 0 CA--C 1.494 -1.207 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.418 HD13 HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.494 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.483 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.516 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.596 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.416 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.465 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.447 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.544 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.544 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.418 HD23 HD13 ' A' ' 22' ' ' LEU . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.596 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.469 ' HB3' HG11 ' A' ' 108' ' ' VAL . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.428 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.401 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.401 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.53 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.469 HG11 ' HB3' ' A' ' 78' ' ' SER . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm . . . . . 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 110.289 -0.263 . . . . 0.0 110.289 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.438 ' HG ' HG13 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.487 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.426 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.559 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.559 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.517 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . 0.58 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.474 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.492 ' HB3' ' NE2' ' A' ' 85' ' ' GLN . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.492 ' NE2' ' HB3' ' A' ' 83' ' ' SER . 1.3 mp0 -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.561 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 97' ' ' ALA . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 t . . . . . 0 CA--C 1.505 -0.767 0 N-CA-C 107.668 -1.234 . . . . 0.0 107.668 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -136.26 -138.58 0.15 Allowed 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 104.877 -2.268 . . . . 0.0 104.877 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.5 75.57 0.32 Allowed 'General case' 0 C--O 1.247 0.944 0 CA-C-O 122.191 0.996 . . . . 0.0 110.062 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.5 111.95 30.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-N 114.124 -1.398 . . . . 0.0 109.432 -173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 tt -84.89 88.79 7.45 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 174.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.66 101.92 5.17 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.44 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 t -89.79 82.69 6.22 Favored 'General case' 0 N--CA 1.419 -2.01 0 CA-C-O 122.512 1.149 . . . . 0.0 109.51 178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.8 ptt? -132.28 28.19 4.41 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -80.85 82.67 6.78 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 114.517 -1.219 . . . . 0.0 111.704 -174.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.498 ' HB ' ' HD3' ' A' ' 11' ' ' PRO . 53.3 t -87.58 -51.05 0.42 Allowed Pre-proline 0 C--N 1.301 -1.505 0 CA-C-N 114.569 -1.196 . . . . 0.0 110.03 174.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 10' ' ' VAL . 21.0 Cg_endo -98.85 -169.72 0.11 Allowed 'Trans proline' 0 N--CA 1.437 -1.824 0 C-N-CA 121.597 1.531 . . . . 0.0 110.867 174.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.89 152.27 28.1 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 105.723 -1.954 . . . . 0.0 105.723 175.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 168.16 96.2 0.1 Allowed Glycine 0 N--CA 1.427 -1.953 0 C-N-CA 118.731 -1.7 . . . . 0.0 113.244 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.29 153.98 56.33 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 121.979 1.786 . . . . 0.0 109.704 173.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.43 93.57 3.48 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 -178.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.81 -164.6 40.14 Favored Glycine 0 N--CA 1.445 -0.726 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.178 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -115.66 138.59 14.74 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -93.64 -34.35 13.32 Favored 'General case' 0 C--N 1.312 -1.029 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.424 -177.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.59 -59.23 2.3 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -178.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.4 t -92.87 106.78 18.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.72 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.4 ' O ' HG12 ' A' ' 25' ' ' VAL . 31.3 t70 -74.43 114.3 12.66 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.295 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.49 -36.06 73.19 Favored 'General case' 0 N--CA 1.435 -1.199 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -176.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -74.9 -20.77 59.57 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.467 0.544 . . . . 0.0 112.467 -175.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.0 m -99.3 -11.88 20.84 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.637 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.404 HG13 ' HG ' ' A' ' 26' ' ' LEU . 7.7 p -104.07 -36.01 3.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 120.953 0.406 . . . . 0.0 110.366 178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.404 ' HG ' HG13 ' A' ' 25' ' ' VAL . 90.9 mt -108.72 125.02 51.46 Favored 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 177.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 22.9 p -101.04 158.65 31.39 Favored Pre-proline 0 C--N 1.299 -1.612 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.283 -179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.9 -42.72 50.74 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.149 2.566 . . . . 0.0 113.094 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -59.3 -25.85 64.48 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 113.156 0.799 . . . . 0.0 113.156 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -84.77 -34.65 9.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.589 0.709 . . . . 0.0 109.532 179.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.44 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 30.1 mmt -83.7 -31.22 26.2 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.595 -0.729 . . . . 0.0 112.469 -176.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -50.9 -53.18 50.46 Favored Pre-proline 0 C--N 1.32 -0.707 0 N-CA-C 114.374 1.249 . . . . 0.0 114.374 -177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -63.38 -26.36 71.05 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 121.679 1.586 . . . . 0.0 111.911 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.445 HG23 ' CE2' ' A' ' 93' ' ' PHE . 71.9 mt -77.93 -55.6 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.817 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp -67.48 -19.79 65.38 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 -177.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.08 -11.95 60.99 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.184 0.516 . . . . 0.0 110.632 176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 29.6 t30 -87.02 116.58 25.17 Favored 'General case' 0 N--CA 1.437 -1.094 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -60.77 -23.26 64.85 Favored 'General case' 0 C--N 1.313 -0.991 0 C-N-CA 123.306 0.643 . . . . 0.0 112.123 -176.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.558 ' OD1' HD11 ' A' ' 89' ' ' LEU . 9.1 t70 -67.23 -41.15 86.2 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.436 0.636 . . . . 0.0 109.628 -179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.1 m -74.17 -31.11 28.5 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.666 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -58.72 -38.47 78.4 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.81 177.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 43.9 mt-10 -58.25 -43.7 87.97 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.598 175.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -75.6 -23.82 56.48 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 40' ' ' VAL . 28.3 mt -85.27 -23.17 28.29 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.5 mt -43.84 -51.2 17.67 Favored Pre-proline 0 N--CA 1.479 1.019 0 N-CA-C 114.876 1.436 . . . . 0.0 114.876 179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -63.38 -17.07 58.34 Favored 'Trans proline' 0 C--N 1.376 1.983 0 C-N-CA 122.356 2.037 . . . . 0.0 113.488 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -112.4 -0.89 15.19 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.005 -174.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.461 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.8 tp -61.43 113.77 9.04 Favored Pre-proline 0 C--O 1.241 0.615 0 C-N-CA 123.92 0.888 . . . . 0.0 110.36 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -63.83 157.66 51.08 Favored 'Trans proline' 0 C--O 1.25 1.088 0 C-N-CA 122.542 2.161 . . . . 0.0 112.049 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.9 m -71.07 122.7 20.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.598 -176.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.52 -18.38 38.3 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 121.186 -0.53 . . . . 0.0 111.844 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -83.66 154.03 23.92 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.4 m -134.52 158.56 43.65 Favored 'General case' 0 C--N 1.291 -1.972 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 82.8 mt -98.39 110.14 55.33 Favored Pre-proline 0 C--N 1.297 -1.684 0 O-C-N 123.692 0.62 . . . . 0.0 110.6 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 3.6 Cg_exo -75.58 143.32 27.17 Favored 'Trans proline' 0 CA--C 1.546 1.094 0 C-N-CA 122.527 2.151 . . . . 0.0 110.335 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.68 -40.62 11.17 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -173.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.501 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 29.9 p -100.97 146.58 27.21 Favored 'General case' 0 C--N 1.294 -1.818 0 C-N-CA 120.673 -0.411 . . . . 0.0 111.007 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.18 -42.47 73.23 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.859 0.463 . . . . 0.0 111.688 -177.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -57.6 -47.98 80.66 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.073 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 57' ' ' THR . 15.7 pt-20 -72.2 -25.04 61.51 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 119.871 -0.732 . . . . 0.0 110.192 -177.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.501 HG13 ' O ' ' A' ' 57' ' ' THR . 69.8 mt -62.95 -45.23 99.4 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.922 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 175.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.515 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.3 mm100 -61.74 -38.82 89.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.48 0.657 . . . . 0.0 110.18 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -68.67 -39.83 80.41 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.027 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.0 p -85.24 -47.6 9.93 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-O 121.431 0.634 . . . . 0.0 111.761 -176.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 43.2 mt -94.95 70.72 3.37 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-O 121.667 0.746 . . . . 0.0 109.843 -177.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -79.7 -56.07 4.55 Favored 'General case' 0 N--CA 1.425 -1.704 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.604 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.548 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 69.2 m -150.9 -66.94 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.45 0 CA-C-O 118.059 -0.972 . . . . 0.0 112.748 178.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.548 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 53.0 Cg_exo -57.43 -54.24 3.72 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 121.783 1.655 . . . . 0.0 112.145 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -64.92 -31.18 72.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.347 0.594 . . . . 0.0 109.856 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -64.82 -42.99 94.53 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.004 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.467 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 25.5 mt-30 -65.57 -32.29 73.8 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.108 0.48 . . . . 0.0 111.231 -179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -73.39 -49.16 28.64 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.641 177.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -67.28 -35.05 78.7 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.247 0.546 . . . . 0.0 111.334 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 25.5 tp -74.51 -24.98 59.07 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.63 -31.55 62.67 Favored Glycine 0 N--CA 1.435 -1.38 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.802 178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 73' ' ' ALA . 27.4 ptt? -80.49 -26.4 38.24 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 55.7 t80 -61.72 -54.46 42.29 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.118 -0.946 . . . . 0.0 108.906 175.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.9 p -66.46 -25.79 66.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.942 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.2 -45.61 76.39 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.082 177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.09 -30.98 65.64 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.356 0.598 . . . . 0.0 109.872 178.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.481 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.6 tt -64.28 -46.65 82.74 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.881 -1.054 . . . . 0.0 109.289 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.69 -31.19 69.35 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.123 0.487 . . . . 0.0 111.89 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.6 m -80.86 -12.23 59.46 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.538 179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 83.33 -2.16 87.56 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 121.083 -0.579 . . . . 0.0 112.345 -179.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -71.3 -23.64 61.99 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.305 0.574 . . . . 0.0 110.47 -177.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.476 HD11 ' HB ' ' A' ' 40' ' ' VAL . 15.1 tp -102.17 9.0 40.46 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.765 -176.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.26 -67.28 2.11 Favored Glycine 0 CA--C 1.529 0.946 0 CA-C-N 115.662 -0.699 . . . . 0.0 114.504 -175.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -50.51 -29.5 24.8 Favored 'Trans proline' 0 C--N 1.366 1.482 0 C-N-CA 124.262 3.308 . . . . 0.0 113.652 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.558 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -58.38 -36.42 73.48 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.113 -0.949 . . . . 0.0 112.995 -177.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.517 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 22.9 mmt -64.2 -31.69 72.99 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -172.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.43 ' HB2' HG21 ' A' ' 100' ' ' VAL . 51.7 t -71.8 -24.7 61.78 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.779 -178.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -77.02 -13.79 59.91 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.99 0.424 . . . . 0.0 111.252 -176.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CE2' HG23 ' A' ' 34' ' ' ILE . 50.9 m-85 -96.52 -1.48 47.1 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.523 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.61 38.1 44.44 Favored Glycine 0 C--O 1.245 0.8 0 C-N-CA 120.183 -1.008 . . . . 0.0 110.614 -176.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 90' ' ' MET . 2.8 mp -88.24 155.55 51.81 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.502 178.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -48.84 143.69 16.64 Favored 'Trans proline' 0 C--O 1.248 0.988 0 C-N-CA 123.464 2.776 . . . . 0.0 113.017 178.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.58 -36.67 79.09 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.228 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.433 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 43.7 mt-10 -67.84 -32.62 73.28 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.408 -0.814 . . . . 0.0 110.261 179.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.95 -44.7 47.03 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.683 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.43 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.1 p -66.07 -36.58 77.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.943 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -60.0 -48.69 80.67 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.58 -40.8 88.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.428 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.43 -28.95 69.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.627 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.51 -36.25 33.48 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.926 0.393 . . . . 0.0 110.684 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.522 ' HE3' ' HA ' ' A' ' 105' ' ' LYS . 0.0 OUTLIER -73.97 -23.12 59.43 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.782 178.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.481 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 86.32 27.37 30.64 Favored Glycine 0 N--CA 1.428 -1.886 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.646 178.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -102.35 112.11 24.69 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -178.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 23.1 m -77.22 -28.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -77.91 -39.73 42.0 Favored 'General case' 0 N--CA 1.442 -0.832 0 C-N-CA 119.442 -0.903 . . . . 0.0 109.98 -177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.12 -37.03 85.98 Favored 'General case' 0 N--CA 1.447 -0.61 0 C-N-CA 122.566 0.346 . . . . 0.0 110.804 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -63.29 -51.74 64.84 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -61.08 -40.81 95.11 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.875 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.441 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 88.2 mttt -64.55 -53.24 50.96 Favored 'General case' 0 CA--C 1.486 -1.497 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.017 178.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -68.83 -27.95 66.3 Favored 'General case' 0 N--CA 1.419 -2.017 0 C-N-CA 119.835 -0.746 . . . . 0.0 111.758 -175.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 52.9 tpp -58.57 -59.88 4.68 Favored 'General case' 0 C--O 1.217 -0.635 0 O-C-N 123.695 0.622 . . . . 0.0 110.592 177.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.441 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.319 2.2 pp0? -77.96 -6.49 54.59 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.793 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -89.37 -36.04 15.73 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.312 174.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -99.37 -38.9 8.65 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -177.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.62 14.28 13.69 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -51.02 110.64 1.85 Allowed Pre-proline 0 C--O 1.247 0.944 0 C-N-CA 126.407 1.883 . . . . 0.0 109.373 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -79.78 77.13 4.2 Favored 'Trans proline' 0 N--CA 1.432 -2.121 0 C-N-CA 122.342 2.028 . . . . 0.0 112.994 -175.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -121.72 9.52 10.15 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 107.999 -1.112 . . . . 0.0 107.999 175.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 46.55 59.28 3.98 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 126.261 1.824 . . . . 0.0 113.518 -177.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.9 ttmt -92.64 96.25 10.07 Favored 'General case' 0 N--CA 1.413 -2.311 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -139.6 113.47 8.69 Favored 'General case' 0 C--N 1.284 -2.272 0 CA-C-N 114.45 -1.25 . . . . 0.0 108.47 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 113.56 42.62 0.87 Allowed Glycine 0 C--N 1.297 -1.621 0 C-N-CA 120.325 -0.941 . . . . 0.0 113.617 175.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -78.82 100.97 7.39 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 122.182 0.992 . . . . 0.0 109.255 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 53.4 m -149.94 134.93 17.86 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.642 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -89.99 72.95 7.4 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.291 0.567 . . . . 0.0 111.772 177.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -122.44 3.95 9.67 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 6.9 ttpm? -152.44 166.3 32.35 Favored 'General case' 0 N--CA 1.426 -1.661 0 N-CA-C 105.531 -2.025 . . . . 0.0 105.531 -178.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt 82.98 123.38 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 125.906 1.682 . . . . 0.0 110.486 -176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.25 85.66 3.74 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -81.92 -13.95 56.81 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.387 0.613 . . . . 0.0 110.551 -176.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -125.37 105.8 9.36 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 172.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.98 172.8 6.63 Favored 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.374 -175.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -90.92 174.23 7.55 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.8 tpt -116.03 -23.37 8.55 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-O 121.112 0.482 . . . . 0.0 110.515 -178.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.5 t -83.44 110.96 18.6 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.224 -174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 85.8 mt 69.89 -42.12 0.5 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.678 1.591 . . . . 0.0 114.768 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.9 t70 . . . . . 0 C--N 1.301 -1.506 0 C-N-CA 123.203 0.601 . . . . 0.0 111.379 -176.145 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.5 p . . . . . 0 N--CA 1.442 -0.872 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.3 p-10 -56.46 -63.24 1.26 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.993 0.517 . . . . 0.0 111.15 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 61.63 -50.88 0.13 Allowed 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 116.723 2.12 . . . . 0.0 116.723 173.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.566 HD12 ' N ' ' A' ' 5' ' ' LEU . 2.4 pp -52.25 -32.03 15.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 116.587 2.069 . . . . 0.0 116.587 -171.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 4' ' ' ILE . 56.4 tp -142.06 98.14 3.27 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.17 69.25 1.0 Allowed 'General case' 0 C--N 1.293 -1.871 0 N-CA-C 107.285 -1.376 . . . . 0.0 107.285 178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.0 m -90.55 -46.37 8.35 Favored 'General case' 0 N--CA 1.426 -1.654 0 CA-C-N 114.575 -1.193 . . . . 0.0 109.82 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -83.74 61.22 6.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.582 0.706 . . . . 0.0 112.596 -178.356 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.3 p30 -174.79 -179.49 1.46 Allowed 'General case' 0 C--O 1.247 0.973 0 C-N-CA 123.801 0.84 . . . . 0.0 110.644 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.529 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 17.3 m -88.2 174.15 5.49 Favored Pre-proline 0 C--N 1.303 -1.455 0 C-N-CA 124.298 1.039 . . . . 0.0 108.5 175.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.529 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 5.6 Cg_exo -38.39 -52.4 1.96 Allowed 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 124.13 3.22 . . . . 0.0 113.153 175.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.53 171.75 0.19 Allowed 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.592 1.157 . . . . 0.0 113.449 175.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.76 121.0 0.95 Allowed Glycine 0 N--CA 1.43 -1.717 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.332 179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -55.57 -45.09 42.12 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.475 2.117 . . . . 0.0 110.976 177.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.69 99.55 8.48 Favored 'General case' 0 N--CA 1.433 -1.32 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -79.21 77.64 1.81 Allowed Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.81 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -159.79 152.93 23.9 Favored Glycine 0 N--CA 1.43 -1.765 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 178.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 79.8 mm-40 -115.61 147.73 40.44 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 117.194 0.497 . . . . 0.0 111.605 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -150.21 153.32 36.04 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.5 t 55.96 82.51 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.244 0.788 0 O-C-N 124.389 1.055 . . . . 0.0 110.367 179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.515 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.6 t70 -66.44 124.06 21.71 Favored 'General case' 0 CA--C 1.496 -1.121 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.741 -178.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.513 HD12 ' N ' ' A' ' 23' ' ' ALA . 2.8 pp -50.67 -46.57 58.7 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -175.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.15 -17.37 50.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.0 111.602 -175.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 m -82.72 -39.22 22.23 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.526 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 21' ' ' ASP . 8.6 p -85.82 -42.96 16.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.808 -178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -106.32 107.08 17.91 Favored 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.5 p -90.3 157.35 45.13 Favored Pre-proline 0 N--CA 1.422 -1.847 0 CA-C-N 115.769 -0.65 . . . . 0.0 111.43 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -49.61 -35.65 38.3 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 123.886 3.057 . . . . 0.0 114.395 -177.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 pm0 -60.16 -40.04 88.49 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.026 0.441 . . . . 0.0 111.599 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.35 -38.72 54.23 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-O 121.562 0.696 . . . . 0.0 110.432 -179.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 77.2 mmm -85.89 -18.16 33.53 Favored 'General case' 0 C--N 1.309 -1.17 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -171.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -53.98 -55.2 38.68 Favored Pre-proline 0 CA--C 1.545 0.769 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -67.36 -17.09 49.29 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 121.468 1.445 . . . . 0.0 112.948 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.9 mt -83.58 -55.69 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.5 -17.09 64.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.603 -177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.18 -16.31 63.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.058 0.456 . . . . 0.0 111.039 177.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.509 ' O ' HG22 ' A' ' 40' ' ' VAL . 49.1 t-20 -83.5 118.08 23.53 Favored 'General case' 0 N--CA 1.444 -0.743 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.88 -24.86 66.28 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 112.155 -177.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -73.68 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-O 120.91 0.386 . . . . 0.0 110.499 -178.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 37' ' ' ASN . 6.3 m -73.55 -34.08 41.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.579 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.7 mt-30 -61.59 -32.83 72.95 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 114.977 -1.011 . . . . 0.0 110.331 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -61.9 -39.14 90.95 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 10.9 mpt_? -72.47 -26.84 61.96 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.782 176.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.484 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.5 mp -83.29 -18.24 39.76 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.529 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.0 mt -48.55 -49.44 64.53 Favored Pre-proline 0 N--CA 1.478 0.972 0 N-CA-C 115.265 1.58 . . . . 0.0 115.265 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -65.07 -13.23 38.64 Favored 'Trans proline' 0 C--N 1.369 1.61 0 C-N-CA 121.479 1.452 . . . . 0.0 112.633 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.488 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 45.3 m-85 -114.16 5.99 16.13 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.974 -176.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.428 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.7 tp -53.22 132.28 51.64 Favored Pre-proline 0 N--CA 1.478 0.927 0 C-N-CA 124.215 1.006 . . . . 0.0 111.516 -177.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.66 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 53.7 Cg_exo -59.5 158.92 25.43 Favored 'Trans proline' 0 C--N 1.361 1.203 0 C-N-CA 123.481 2.788 . . . . 0.0 112.046 176.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.7 m -73.41 116.02 13.48 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -171.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 72.06 23.97 77.2 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.455 -0.793 . . . . 0.0 114.065 174.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -122.52 166.25 15.1 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 117.254 0.527 . . . . 0.0 110.01 179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 m -112.55 178.34 4.33 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-O 121.199 0.523 . . . . 0.0 111.78 -171.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.579 HD13 ' HB3' ' A' ' 41' ' ' GLN . 62.0 mt -108.32 112.41 61.14 Favored Pre-proline 0 C--N 1.305 -1.343 0 C-N-CA 123.809 0.844 . . . . 0.0 110.299 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -67.92 133.32 28.84 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.375 2.05 . . . . 0.0 110.795 177.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -89.17 -56.29 3.33 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.403 ' O ' HG13 ' A' ' 61' ' ' ILE . 41.5 p -84.67 153.61 23.02 Favored 'General case' 0 C--N 1.311 -1.079 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.901 -177.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.447 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.75 -28.5 68.75 Favored 'General case' 0 C--O 1.214 -0.772 0 CA-C-O 121.103 0.478 . . . . 0.0 110.077 178.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -57.12 -57.12 13.97 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.322 1.049 . . . . 0.0 110.176 176.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.409 ' HA ' ' CG ' ' A' ' 63' ' ' ASN . 11.7 pt-20 -72.16 -25.18 61.59 Favored 'General case' 0 C--O 1.215 -0.758 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.809 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 57' ' ' THR . 71.3 mt -64.63 -45.43 95.4 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.079 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 80.4 mm-40 -65.46 -35.14 80.0 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.598 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.409 ' CG ' ' HA ' ' A' ' 60' ' ' GLU . 25.5 p30 -83.0 -40.16 20.33 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -177.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 62.7 m -87.87 -42.17 12.71 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.381 0.61 . . . . 0.0 111.309 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.4 ' C ' ' HB2' ' A' ' 70' ' ' PHE . 58.6 mt -102.61 67.89 1.02 Allowed 'General case' 0 C--N 1.299 -1.604 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -177.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.8 t -91.53 -43.85 9.43 Favored 'General case' 0 N--CA 1.42 -1.973 0 CA-C-N 115.179 -0.919 . . . . 0.0 110.724 -178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 71' ' ' GLN . 32.8 t -155.07 -69.92 0.02 OUTLIER Pre-proline 0 CA--C 1.553 1.085 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.121 177.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -56.27 -55.45 2.84 Favored 'Trans proline' 0 C--N 1.384 2.422 0 C-N-CA 121.851 1.701 . . . . 0.0 112.954 -177.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -72.76 -24.18 60.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.205 0.526 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.4 ' HB2' ' C ' ' A' ' 65' ' ' LEU . 75.9 t80 -66.59 -44.87 81.02 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.085 179.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 67' ' ' SER . 52.8 mt-30 -57.23 -42.61 81.72 Favored 'General case' 0 C--O 1.213 -0.816 0 CA-C-O 121.352 0.596 . . . . 0.0 109.689 177.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.477 ' HA ' HD13 ' A' ' 4' ' ' ILE . 24.0 mt-30 -63.36 -47.59 81.46 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.897 179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.65 -38.91 87.84 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.415 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.411 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 27.5 tp -75.41 -25.49 57.61 Favored 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.861 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.428 ' HA3' ' CG1' ' A' ' 4' ' ' ILE . . . -72.19 -44.7 43.13 Favored Glycine 0 N--CA 1.432 -1.577 0 N-CA-C 111.543 -0.623 . . . . 0.0 111.543 175.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.66 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.2 ptt? -65.32 -32.44 74.09 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.722 176.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 64.0 t80 -59.62 -50.71 72.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.724 173.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.422 ' HB3' HG11 ' A' ' 108' ' ' VAL . 61.8 m -60.98 -33.94 74.0 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.746 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.16 -43.99 76.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 120.956 0.408 . . . . 0.0 110.599 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.18 -33.27 73.1 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.171 0.51 . . . . 0.0 110.525 178.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.454 HD22 HG12 ' A' ' 108' ' ' VAL . 6.3 tt -67.62 -46.84 71.37 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.147 178.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.6 -21.58 65.74 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 121.565 0.698 . . . . 0.0 111.563 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 43.8 t -82.64 -18.42 41.17 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 115.166 -0.924 . . . . 0.0 110.338 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.17 -8.77 69.17 Favored Glycine 0 CA--C 1.52 0.377 0 C-N-CA 121.111 -0.566 . . . . 0.0 112.191 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -70.62 -26.33 63.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.169 0.509 . . . . 0.0 111.311 -178.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.404 HD11 ' HB ' ' A' ' 40' ' ' VAL . 32.3 tp -97.54 4.04 50.44 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.437 0.637 . . . . 0.0 110.577 -177.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.439 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.43 -62.75 5.49 Favored Glycine 0 CA--C 1.533 1.175 0 N-CA-C 115.135 0.814 . . . . 0.0 115.135 -177.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -52.54 -29.43 40.46 Favored 'Trans proline' 0 C--N 1.365 1.426 0 C-N-CA 123.801 3.0 . . . . 0.0 113.793 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.7 mm? -59.21 -32.19 69.72 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.779 0.831 . . . . 0.0 112.879 -176.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.403 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 20.7 mmt -71.27 -20.53 62.21 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.161 0.505 . . . . 0.0 111.899 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.5 -37.88 77.4 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.659 -178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 14.3 pt20 -82.55 -1.12 49.72 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -175.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 95' ' ' LEU . 42.9 m-85 -100.71 -3.01 31.03 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.003 0.43 . . . . 0.0 110.18 176.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.8 33.01 56.38 Favored Glycine 0 C--N 1.33 0.202 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.849 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 93' ' ' PHE . 5.4 mp -81.69 157.18 69.93 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.541 0.337 . . . . 0.0 111.314 -179.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -51.22 147.53 20.68 Favored 'Trans proline' 0 C--O 1.252 1.206 0 C-N-CA 123.461 2.774 . . . . 0.0 112.717 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.17 -31.86 72.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.104 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -70.92 -36.34 72.63 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.69 -51.46 49.3 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.42 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 8.5 p -64.16 -34.37 68.45 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.225 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -64.47 -47.03 80.53 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 121.134 0.492 . . . . 0.0 109.767 176.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.37 -32.74 74.48 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.125 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.439 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -68.44 -31.56 70.96 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.283 178.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -78.39 -37.64 43.56 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.594 176.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -74.38 -23.6 59.01 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.108 0.48 . . . . 0.0 111.65 178.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.01 29.1 18.87 Favored Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.423 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.14 104.79 14.29 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.454 HG12 HD22 ' A' ' 81' ' ' LEU . 10.8 m -76.29 -28.04 18.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.873 -175.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.0 mp0 -64.11 -49.54 71.8 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.977 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.41 -40.91 93.97 Favored 'General case' 0 CA--C 1.506 -0.743 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.385 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.571 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.1 t80 -58.31 -53.7 55.31 Favored 'General case' 0 CA--C 1.511 -0.522 0 O-C-N 123.79 0.681 . . . . 0.0 110.188 178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.91 89.23 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.837 -177.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -65.77 -47.64 74.5 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -60.89 -33.08 72.56 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.229 -177.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.571 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.5 mmm -66.02 -57.09 8.54 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.905 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.275 0.3 OUTLIER -67.45 -26.64 66.49 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 114.965 1.469 . . . . 0.0 114.965 -175.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -84.31 -30.69 25.36 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 119.441 -0.903 . . . . 0.0 112.535 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.69 -39.13 15.24 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 120.677 -0.409 . . . . 0.0 111.445 177.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -80.86 68.95 7.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.956 0.884 . . . . 0.0 111.422 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -168.83 117.78 0.6 Allowed Pre-proline 0 C--N 1.301 -1.539 0 CA-C-N 113.62 -1.627 . . . . 0.0 107.248 173.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_exo -73.33 -45.97 0.39 Allowed 'Trans proline' 0 CA--C 1.517 -0.363 0 C-N-CA 122.108 1.872 . . . . 0.0 111.354 178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 65.89 179.78 0.2 Allowed 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.633 1.173 . . . . 0.0 111.045 -179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.503 ' NE2' ' HB2' ' A' ' 125' ' ' GLU . 5.9 tt0 -98.76 -39.11 8.8 Favored 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 120.214 -0.594 . . . . 0.0 109.414 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 15.9 ptpt 46.43 74.35 0.15 Allowed 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.263 1.425 . . . . 0.0 112.79 -178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.503 ' HB2' ' NE2' ' A' ' 123' ' ' GLN . 33.1 tt0 -88.96 -69.66 0.7 Allowed 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.539 -1.209 . . . . 0.0 111.437 -175.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 71.33 -88.73 0.42 Allowed Glycine 0 N--CA 1.444 -0.822 0 N-CA-C 109.339 -1.505 . . . . 0.0 109.339 -173.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.501 ' OD2' ' HG3' ' A' ' 129' ' ' LYS . 27.0 t70 -161.41 -60.83 0.05 Allowed 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.417 -1.697 . . . . 0.0 106.417 173.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 m 56.22 82.77 0.1 Allowed 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.89 -1.505 . . . . 0.0 113.165 175.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.501 ' HG3' ' OD2' ' A' ' 127' ' ' ASP . 62.0 mttp -96.99 113.03 24.53 Favored 'General case' 0 CA--C 1.499 -1.004 0 O-C-N 121.491 -0.755 . . . . 0.0 110.535 175.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -95.43 6.37 49.16 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 115.102 -0.954 . . . . 0.0 108.99 177.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.414 ' HE2' ' HB3' ' A' ' 131' ' ' LYS . 46.0 mtpt -74.0 81.02 1.7 Allowed 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 113.621 0.971 . . . . 0.0 113.621 -176.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -102.6 95.3 6.14 Favored 'General case' 0 N--CA 1.415 -2.181 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 167.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -100.95 -4.36 27.76 Favored 'General case' 0 C--N 1.293 -1.866 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.723 -174.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -70.12 138.06 51.62 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 113.269 -1.787 . . . . 0.0 109.54 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -117.41 111.16 18.94 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 173.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 71.06 101.23 0.06 Allowed 'General case' 0 C--O 1.236 0.384 0 C-N-CA 124.412 1.085 . . . . 0.0 110.368 -176.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -94.51 105.29 17.25 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-O 121.105 0.479 . . . . 0.0 109.807 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 86.4 mtp -131.8 126.66 34.91 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.818 177.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.1 m -107.87 29.3 7.38 Favored 'General case' 0 C--N 1.283 -2.283 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 175.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp 61.23 64.26 1.12 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 113.365 -1.743 . . . . 0.0 108.533 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 CA--C 1.495 -1.142 0 CA-C-N 113.03 -1.896 . . . . 0.0 107.762 -176.211 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.1 p . . . . . 0 CA--C 1.535 0.38 0 CA-C-O 120.939 0.4 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -153.77 127.21 8.6 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 123.824 0.85 . . . . 0.0 108.938 177.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 71.35 -39.03 0.44 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 125.541 1.536 . . . . 0.0 113.865 177.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.28 129.59 32.93 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.652 0 C-N-CA 125.051 1.34 . . . . 0.0 111.229 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 35.7 tp -115.6 156.2 26.25 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 176.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.33 -6.61 25.13 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -174.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.8 p -90.26 -1.7 57.95 Favored 'General case' 0 C--N 1.305 -1.326 0 C-N-CA 122.972 0.509 . . . . 0.0 110.154 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.8 mmt 61.04 68.01 0.77 Allowed 'General case' 0 C--O 1.24 0.593 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.842 -177.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -137.78 136.5 37.31 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 106.329 -1.73 . . . . 0.0 106.329 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.0 t 62.74 95.39 0.05 OUTLIER Pre-proline 0 CA--C 1.539 0.535 0 O-C-N 124.136 0.897 . . . . 0.0 109.403 -173.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -79.62 3.59 7.4 Favored 'Trans proline' 0 C--N 1.336 -0.12 0 C-N-CA 122.933 2.422 . . . . 0.0 113.783 -174.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.35 99.54 0.04 OUTLIER 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.483 1.113 . . . . 0.0 111.002 -177.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -165.11 161.04 34.44 Favored Glycine 0 N--CA 1.422 -2.258 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -81.27 40.01 0.93 Allowed 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 123.267 2.645 . . . . 0.0 111.283 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.73 110.52 5.62 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.126 -178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -155.37 119.29 0.91 Allowed Glycine 0 N--CA 1.422 -2.293 0 N-CA-C 110.228 -1.149 . . . . 0.0 110.228 177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 78.57 -59.03 4.13 Favored Glycine 0 C--O 1.241 0.572 0 C-N-CA 121.829 -0.224 . . . . 0.0 113.348 177.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 69.32 169.09 0.29 Allowed 'General case' 0 C--O 1.24 0.556 0 C-N-CA 125.502 1.521 . . . . 0.0 112.372 -178.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 65.38 -81.84 0.03 OUTLIER 'General case' 0 C--O 1.242 0.659 0 C-N-CA 124.191 0.996 . . . . 0.0 110.909 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.1 t -128.38 77.88 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.465 ' O ' HG12 ' A' ' 25' ' ' VAL . 7.6 t70 -96.43 132.05 42.36 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.154 175.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.67 -37.23 86.86 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.2 -28.42 53.88 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.257 0.551 . . . . 0.0 112.048 -174.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.9 p -81.97 -32.45 30.69 Favored 'General case' 0 C--N 1.3 -1.585 0 CA-C-N 116.042 -0.526 . . . . 0.0 112.151 178.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 21' ' ' ASP . 13.5 p -83.57 -36.91 12.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 CA-C-O 120.873 0.368 . . . . 0.0 110.745 177.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HG ' HG13 ' A' ' 25' ' ' VAL . 96.0 mt -120.92 103.36 9.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.42 -0.955 . . . . 0.0 108.42 178.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 24.6 p -85.35 160.71 53.66 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.663 -175.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -53.68 -31.08 58.9 Favored 'Trans proline' 0 C--N 1.374 1.914 0 C-N-CA 123.286 2.658 . . . . 0.0 113.15 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.09 -33.49 65.64 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.644 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 68.6 mt -78.56 -37.22 20.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.298 0.57 . . . . 0.0 109.476 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.429 ' SD ' ' HB3' ' A' ' 26' ' ' LEU . 84.3 mmm -87.01 -6.53 58.71 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.217 -175.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -55.74 -55.33 41.93 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 113.682 0.993 . . . . 0.0 113.682 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -65.59 -30.91 51.14 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 121.04 1.16 . . . . 0.0 112.035 -179.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.2 mt -67.52 -54.01 27.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.772 -177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.3 mp -72.25 -11.99 60.96 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -177.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.21 -4.69 46.03 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.11 0.481 . . . . 0.0 110.836 177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' HG22 ' A' ' 40' ' ' VAL . 52.6 t-20 -94.78 125.16 39.26 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.22 -21.51 66.31 Favored 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 122.923 0.489 . . . . 0.0 111.889 -177.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -66.81 -40.22 88.0 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-O 121.201 0.524 . . . . 0.0 109.954 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.48 HG22 ' O ' ' A' ' 37' ' ' ASN . 12.6 m -75.58 -32.88 25.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 C-N-CA 119.877 -0.729 . . . . 0.0 109.311 178.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.558 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 80.9 mt-30 -60.97 -38.46 86.01 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.175 177.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.48 79.45 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.596 0.758 . . . . 0.0 109.164 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -77.35 -28.75 53.14 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.124 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.7 mp -83.11 -29.5 28.67 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 73.7 mt -47.57 -43.93 52.08 Favored Pre-proline 0 CA--C 1.563 1.471 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -64.55 -15.51 50.33 Favored 'Trans proline' 0 C--N 1.366 1.461 0 C-N-CA 121.887 1.724 . . . . 0.0 112.928 176.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.417 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 70.8 m-85 -113.9 9.35 17.49 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.362 -176.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 41.4 tp -55.77 131.52 72.47 Favored Pre-proline 0 N--CA 1.481 1.123 0 C-N-CA 124.453 1.101 . . . . 0.0 111.848 -177.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.68 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 7.2 Cg_exo -75.01 148.17 34.87 Favored 'Trans proline' 0 C--O 1.245 0.834 0 C-N-CA 122.411 2.074 . . . . 0.0 110.692 175.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.0 m -76.29 116.58 17.11 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.029 0.443 . . . . 0.0 110.456 -177.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.9 -4.59 34.15 Favored Glycine 0 C--O 1.246 0.87 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.126 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -108.13 164.0 12.67 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.39 0.614 . . . . 0.0 110.569 178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -144.67 159.84 42.17 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 30.9 mt -95.3 111.96 56.96 Favored Pre-proline 0 C--N 1.292 -1.915 0 O-C-N 123.47 0.481 . . . . 0.0 111.312 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -63.37 133.37 39.98 Favored 'Trans proline' 0 N--CA 1.45 -1.044 0 C-N-CA 122.278 1.985 . . . . 0.0 109.666 175.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -80.29 -30.46 38.28 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.958 -174.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.45 ' O ' HG13 ' A' ' 61' ' ' ILE . 37.8 p -104.68 148.33 26.68 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.804 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -62.26 -29.43 70.4 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.298 178.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -59.42 -51.47 69.77 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.592 177.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -67.36 -31.05 71.03 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.891 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 57' ' ' THR . 69.9 mt -60.88 -40.41 85.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -71.06 -21.8 62.2 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.09 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.1 m-20 -87.09 -57.63 2.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.231 -178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 30.3 m -79.02 -45.18 20.74 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -174.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 76.9 mt -94.25 88.12 5.47 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 122.006 0.908 . . . . 0.0 111.363 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.522 ' O ' ' HD2' ' A' ' 68' ' ' PRO . 74.0 m -142.15 116.57 9.61 Favored 'General case' 0 C--N 1.295 -1.792 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.045 176.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.41 23.8 m 71.19 -97.96 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.039 0 C-N-CA 126.013 1.725 . . . . 0.0 115.232 -178.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.522 ' HD2' ' O ' ' A' ' 66' ' ' THR . 18.9 Cg_endo -60.4 -56.87 0.87 Allowed 'Trans proline' 0 C--N 1.396 3.06 0 CA-C-N 123.422 2.258 . . . . 0.0 112.893 -176.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -64.91 -27.8 69.1 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-O 120.785 0.326 . . . . 0.0 110.36 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -70.94 -41.82 70.65 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.519 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -66.05 -28.49 68.89 Favored 'General case' 0 C--O 1.206 -1.185 0 CA-C-O 120.867 0.365 . . . . 0.0 110.065 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -73.95 -46.24 45.31 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.316 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.3 -39.7 81.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.432 0.634 . . . . 0.0 110.606 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -77.13 -20.73 55.22 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 78' ' ' SER . . . -71.11 -42.21 59.05 Favored Glycine 0 N--CA 1.447 -0.593 0 N-CA-C 110.884 -0.887 . . . . 0.0 110.884 175.462 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.68 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.4 ptt? -72.43 -27.77 62.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.248 -0.581 . . . . 0.0 109.726 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.425 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 43.7 t80 -61.68 -48.57 80.2 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 172.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.413 ' HB3' ' O ' ' A' ' 75' ' ' GLY . 46.4 t -54.64 -45.56 73.78 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.132 0.973 . . . . 0.0 110.315 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -44.49 94.43 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.641 179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.4 -32.12 71.95 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 121.098 0.475 . . . . 0.0 110.865 179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.443 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.79 -48.96 62.34 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 177.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.99 70.63 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.238 0.542 . . . . 0.0 110.608 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.2 t -69.73 -23.71 63.44 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.485 177.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.77 -12.72 66.37 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.074 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -72.83 -9.9 59.19 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-O 121.12 0.486 . . . . 0.0 112.01 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.407 HD21 ' CE2' ' A' ' 77' ' ' PHE . 24.1 tp -111.24 7.99 21.35 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.718 0.77 . . . . 0.0 109.109 -179.037 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.438 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.11 -69.57 1.37 Allowed Glycine 0 N--CA 1.446 -0.688 0 CA-C-N 115.08 -0.964 . . . . 0.0 114.454 -176.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -54.69 -26.91 49.06 Favored 'Trans proline' 0 C--N 1.356 0.959 0 C-N-CA 123.69 2.927 . . . . 0.0 113.424 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.9 mp -63.49 -23.79 67.55 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.262 -0.881 . . . . 0.0 112.395 -177.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -70.77 -22.57 62.38 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.226 0.536 . . . . 0.0 111.728 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.8 t -71.11 -25.09 62.44 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -78.43 -10.44 59.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.979 -176.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.574 ' HB2' HD13 ' A' ' 95' ' ' LEU . 54.9 m-85 -107.82 -2.03 20.32 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-O 120.925 0.393 . . . . 0.0 110.674 179.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 74.77 37.06 46.0 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.9 -178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.574 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.3 mp -81.26 151.11 69.06 Favored Pre-proline 0 C--N 1.307 -1.258 0 O-C-N 122.64 -0.33 . . . . 0.0 111.69 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -48.9 151.25 5.71 Favored 'Trans proline' 0 C--O 1.245 0.865 0 C-N-CA 124.042 3.162 . . . . 0.0 113.071 178.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.37 -39.4 79.47 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.168 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.86 -38.88 92.47 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.228 0.537 . . . . 0.0 110.274 178.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.74 -50.7 48.5 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.719 -177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.7 p -64.11 -35.84 75.01 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.712 -179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 7.2 tp10 -62.06 -51.18 69.02 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.15 -35.09 77.72 Favored 'General case' 0 CA--C 1.513 -0.451 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.353 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.438 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.88 -36.13 81.61 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.628 177.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -74.5 -37.08 63.21 Favored 'General case' 0 CA--C 1.506 -0.747 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.854 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 32.2 mmmt -69.79 -24.32 63.47 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.192 0.52 . . . . 0.0 110.396 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.443 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 85.64 31.0 22.61 Favored Glycine 0 N--CA 1.426 -2.004 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.527 -179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -108.5 106.59 16.75 Favored 'General case' 0 CA--C 1.501 -0.924 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 22.4 m -73.02 -32.03 37.77 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 N-CA-C 112.87 0.693 . . . . 0.0 112.87 -175.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' LYS . 0.3 OUTLIER -81.37 -33.84 32.1 Favored 'General case' 0 N--CA 1.439 -0.985 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.245 -174.996 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.69 -39.03 80.74 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.812 175.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -60.21 -54.01 50.85 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.144 176.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.438 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -60.82 -39.45 89.06 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.945 -179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 109' ' ' GLU . 15.2 ttmm -61.72 -54.86 36.87 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.279 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.61 -38.73 88.69 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.98 -177.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 6.3 tpt -58.49 -52.03 67.36 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.02 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.299 0.4 OUTLIER -69.23 -31.16 69.54 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -177.071 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -92.41 -19.18 22.33 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 118.276 -1.37 . . . . 0.0 112.142 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -94.99 -34.94 12.17 Favored 'General case' 0 CA--C 1.508 -0.635 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.806 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -87.75 71.66 9.56 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 122.322 1.058 . . . . 0.0 108.161 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -111.43 136.24 21.0 Favored Pre-proline 0 C--N 1.287 -2.11 0 CA-C-N 113.196 -1.82 . . . . 0.0 110.551 -176.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -70.38 -32.67 15.59 Favored 'Trans proline' 0 C--O 1.251 1.157 0 C-N-CA 122.487 2.125 . . . . 0.0 111.561 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 66.84 160.09 0.14 Allowed 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.119 1.368 . . . . 0.0 113.706 178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -99.36 -47.07 5.29 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 68.57 -73.99 0.08 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 125.222 1.409 . . . . 0.0 113.24 175.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.94 81.13 3.49 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.274 1.035 . . . . 0.0 112.361 -174.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 158.33 39.88 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.96 0 CA-C-N 114.346 -1.297 . . . . 0.0 111.137 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -149.41 -80.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 119.682 -0.199 . . . . 0.0 111.048 178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 33.0 m 54.98 81.79 0.1 Allowed 'General case' 0 C--O 1.247 0.949 0 C-N-CA 123.663 0.785 . . . . 0.0 111.552 -176.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.6 ptpp? -80.75 74.48 7.69 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.526 1.155 . . . . 0.0 111.382 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -78.26 -38.18 43.34 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 113.533 -1.667 . . . . 0.0 107.758 177.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -127.18 175.84 7.84 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.011 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.25 -169.28 2.55 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 103.214 -2.884 . . . . 0.0 103.214 174.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -73.73 -55.28 6.44 Favored 'General case' 0 CA--C 1.495 -1.159 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 173.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -142.65 164.81 29.1 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 105.047 -2.205 . . . . 0.0 105.047 170.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -108.59 9.31 27.31 Favored 'General case' 0 C--N 1.304 -1.394 0 CA-C-O 122.623 1.201 . . . . 0.0 109.812 -175.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -170.72 166.46 7.96 Favored 'General case' 0 C--N 1.296 -1.761 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.462 ' OD1' HD23 ' A' ' 140' ' ' LEU . 12.4 t70 -122.09 113.41 19.49 Favored 'General case' 0 C--N 1.282 -2.369 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -9.36 57.2 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -176.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 8.7 m -91.78 -50.49 5.71 Favored 'General case' 0 N--CA 1.427 -1.609 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.462 HD23 ' OD1' ' A' ' 137' ' ' ASP . 2.3 pt? -127.21 98.91 5.46 Favored 'General case' 0 N--CA 1.44 -0.955 0 CA-C-O 121.537 0.684 . . . . 0.0 111.492 176.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.5 t70 . . . . . 0 C--N 1.298 -1.658 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.588 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.3 m . . . . . 0 N--CA 1.438 -1.03 0 CA-C-O 120.954 0.407 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -127.93 125.7 40.07 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 -178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.58 3.63 45.46 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-O 120.694 0.283 . . . . 0.0 111.701 -178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 66.9 mt -81.08 88.0 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 176.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -133.75 111.12 10.29 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -112.42 -10.14 13.78 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 173.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.8 t 178.47 -177.64 0.25 Allowed 'General case' 0 N--CA 1.426 -1.633 0 N-CA-C 102.77 -3.048 . . . . 0.0 102.77 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 62.4 mtt -82.3 68.05 8.57 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 120.221 1.373 . . . . 0.0 110.849 177.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 176.59 139.94 0.07 Allowed 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 106.491 -1.67 . . . . 0.0 106.491 -178.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.5 m -88.27 121.54 70.31 Favored Pre-proline 0 N--CA 1.437 -1.082 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.303 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -79.3 -0.22 10.55 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 122.384 2.056 . . . . 0.0 112.629 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.61 94.03 6.75 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -99.95 -134.1 8.37 Favored Glycine 0 N--CA 1.432 -1.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.936 -178.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -62.01 -42.32 30.97 Favored 'Trans proline' 0 C--O 1.245 0.873 0 C-N-CA 122.493 2.129 . . . . 0.0 111.343 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 64.82 22.86 12.6 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.379 1.072 . . . . 0.0 111.777 175.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -104.82 147.81 16.44 Favored Glycine 0 N--CA 1.429 -1.806 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.039 -176.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.83 77.96 1.16 Allowed Glycine 0 N--CA 1.436 -1.345 0 N-CA-C 110.705 -0.958 . . . . 0.0 110.705 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 63.89 -90.03 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.232 1.013 . . . . 0.0 109.726 -174.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -128.39 5.89 5.75 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-O 121.112 0.482 . . . . 0.0 110.115 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 65.1 t -76.26 105.75 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 175.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -70.3 121.07 16.94 Favored 'General case' 0 CA--C 1.492 -1.274 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.43 -38.51 71.68 Favored 'General case' 0 N--CA 1.435 -1.187 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -175.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.41 -14.73 42.5 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-O 121.57 0.7 . . . . 0.0 111.136 -175.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.2 t -81.13 -22.25 39.21 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.377 -0.829 . . . . 0.0 109.351 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.477 HG11 ' HB1' ' A' ' 112' ' ' ALA . 7.7 p -106.73 -43.57 7.03 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.389 -178.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.5 mt -99.12 127.3 45.04 Favored 'General case' 0 CA--C 1.496 -1.106 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 177.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.415 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.2 p -106.01 156.13 37.25 Favored Pre-proline 0 N--CA 1.421 -1.912 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.141 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.47 -33.9 87.6 Favored 'Trans proline' 0 C--N 1.362 1.24 0 C-N-CA 123.132 2.555 . . . . 0.0 112.558 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' HE22 ' A' ' 62' ' ' GLN . 5.6 pm0 -63.92 -42.27 97.43 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 178.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 63.1 mt -65.86 -42.98 93.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 120.919 0.39 . . . . 0.0 111.376 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.513 ' SD ' ' HE1' ' A' ' 70' ' ' PHE . 0.0 OUTLIER -88.42 -2.7 58.74 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 -175.03 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.477 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -58.5 -54.09 59.55 Favored Pre-proline 0 CA--C 1.546 0.826 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.48 -17.84 58.35 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 121.672 1.581 . . . . 0.0 111.972 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.499 HG23 ' CE2' ' A' ' 93' ' ' PHE . 68.7 mt -77.9 -58.13 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.199 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mp -69.33 -17.44 63.71 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.81 -2.59 24.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.123 0.487 . . . . 0.0 111.188 176.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 40' ' ' VAL . 32.9 t30 -98.66 123.77 43.05 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.25 -24.23 67.27 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 24.0 t70 -61.3 -42.75 99.19 Favored 'General case' 0 C--O 1.251 1.143 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.41 177.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.5 m -76.91 -30.87 18.49 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.68 0 C-N-CA 119.798 -0.761 . . . . 0.0 109.645 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.539 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.1 mt-30 -61.84 -37.72 85.52 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.008 177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.82 -36.32 78.77 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.754 177.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.04 -28.0 48.92 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 179.218 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -85.89 -21.92 27.75 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -178.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 67.8 mt -47.42 -49.07 55.83 Favored Pre-proline 0 CA--C 1.561 1.368 0 N-CA-C 114.838 1.422 . . . . 0.0 114.838 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -63.56 -14.9 45.36 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 122.07 1.847 . . . . 0.0 113.137 179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.8 m-85 -113.57 2.22 15.25 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.045 -176.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.469 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 46.9 tp -57.77 123.64 64.4 Favored Pre-proline 0 N--CA 1.473 0.707 0 C-N-CA 123.898 0.879 . . . . 0.0 112.207 -174.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.513 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 23.1 Cg_exo -64.12 151.9 83.39 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.987 2.458 . . . . 0.0 113.694 -178.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 23.2 m -65.8 116.6 7.16 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.133 -177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 92.42 4.04 66.48 Favored Glycine 0 CA--C 1.499 -0.967 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.433 177.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -119.52 166.29 13.31 Favored 'General case' 0 N--CA 1.427 -1.588 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.4 m -146.47 166.07 27.53 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 14.5 mt -89.47 121.56 69.16 Favored Pre-proline 0 C--N 1.297 -1.684 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 177.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 7.3 Cg_exo -73.04 135.13 22.55 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 122.047 1.831 . . . . 0.0 111.795 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -71.33 -43.7 66.51 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.563 -175.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 23.8 p -112.37 155.99 23.24 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -175.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.56 -38.34 69.2 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.192 0.997 . . . . 0.0 112.402 -178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -64.97 -38.67 91.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.68 0.276 . . . . 0.0 110.566 -178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.426 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 23.6 mm-40 -71.78 -33.14 68.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.304 177.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.1 mt -61.66 -45.09 99.39 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 177.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 74.7 mm-40 -68.71 -30.96 69.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.85 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.426 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.0 p30 -89.49 -35.11 16.15 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 113.596 0.962 . . . . 0.0 113.596 -174.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.2 m -90.91 -40.72 11.56 Favored 'General case' 0 C--N 1.298 -1.664 0 CA-C-O 120.956 0.408 . . . . 0.0 111.554 -177.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.0 mt -97.42 91.51 5.51 Favored 'General case' 0 C--N 1.309 -1.176 0 O-C-N 121.617 -0.677 . . . . 0.0 111.535 -175.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.8 t -125.1 141.69 51.96 Favored 'General case' 0 N--CA 1.42 -1.961 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.511 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . 0.373 13.4 t 30.87 -89.55 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.065 0 C-N-CA 128.129 2.571 . . . . 0.0 116.1 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.444 ' O ' ' HG3' ' A' ' 72' ' ' GLN . 20.1 Cg_endo -61.22 -48.04 10.84 Favored 'Trans proline' 0 C--N 1.401 3.3 0 CA-C-N 122.172 1.811 . . . . 0.0 111.504 -178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -66.68 -36.36 82.34 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.426 0.631 . . . . 0.0 109.928 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HE1' ' SD ' ' A' ' 31' ' ' MET . 68.7 t80 -64.9 -37.72 88.56 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.183 179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -67.22 -25.13 65.95 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.132 0.491 . . . . 0.0 111.509 177.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' A' ' 68' ' ' PRO . 15.8 mt-30 -79.04 -43.93 23.24 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.2 -42.7 88.44 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.693 177.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.9 tp -71.63 -20.9 61.9 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.725 178.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.92 -45.71 62.56 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.297 -0.721 . . . . 0.0 111.297 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.513 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 22.0 ptt? -68.84 -30.94 69.58 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.097 0.475 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -61.93 -51.68 67.12 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.671 174.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 37.5 t -57.12 -41.68 79.44 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.074 0.949 . . . . 0.0 110.245 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.78 -50.0 74.12 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.533 179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.43 -29.71 69.91 Favored 'General case' 0 C--O 1.248 0.986 0 CA-C-O 121.216 0.531 . . . . 0.0 111.023 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.7 tt -68.66 -47.7 65.85 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 177.461 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.84 -30.45 70.85 Favored 'General case' 0 C--O 1.239 0.525 0 C-N-CA 122.866 0.466 . . . . 0.0 110.831 179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.8 m -67.74 -22.88 65.21 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.807 176.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 87.17 -12.6 61.93 Favored Glycine 0 C--O 1.225 -0.458 0 N-CA-C 111.518 -0.633 . . . . 0.0 111.518 -176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -74.92 -7.72 54.39 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 123.074 0.549 . . . . 0.0 112.432 -176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -111.69 8.8 20.88 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.477 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -71.46 -69.63 1.36 Allowed Glycine 0 N--CA 1.444 -0.795 0 CA-C-N 114.729 -1.123 . . . . 0.0 113.862 -176.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.43 -22.91 52.79 Favored 'Trans proline' 0 C--N 1.36 1.156 0 C-N-CA 123.222 2.614 . . . . 0.0 112.106 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.658 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.5 mp -65.55 -23.27 66.82 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.605 -179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.6 mmt -74.6 -17.41 60.72 Favored 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.328 0.585 . . . . 0.0 111.559 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 44.5 t -69.71 -32.14 70.56 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.838 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.658 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 24.6 pt20 -73.82 -18.5 60.94 Favored 'General case' 0 N--CA 1.477 0.875 0 CA-C-O 121.077 0.465 . . . . 0.0 111.812 -176.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 34' ' ' ILE . 34.4 m-85 -87.17 -18.18 30.97 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.177 0.513 . . . . 0.0 110.105 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.51 41.75 15.58 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.139 -1.184 . . . . 0.0 110.139 -175.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.435 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.0 OUTLIER -81.22 155.29 72.19 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.839 -0.681 . . . . 0.0 110.506 -179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.406 ' HD2' ' HG ' ' A' ' 95' ' ' LEU . 10.7 Cg_exo -43.45 141.49 3.48 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 123.995 3.13 . . . . 0.0 112.894 177.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.27 -35.64 74.09 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.208 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 50.0 mt-10 -68.95 -33.29 73.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.024 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -76.12 -46.93 26.38 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.833 -177.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.5 p -64.79 -34.28 69.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.344 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -64.17 -48.49 75.77 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.39 -38.36 86.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.326 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.477 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -66.65 -33.84 76.56 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.494 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -71.22 -36.59 71.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-O 121.084 0.469 . . . . 0.0 110.864 176.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -78.54 -23.75 46.03 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.201 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.94 24.22 32.98 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 177.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD1' ' HB2' ' A' ' 109' ' ' GLU . 10.9 t70 -98.81 98.43 9.52 Favored 'General case' 0 N--CA 1.438 -1.044 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -177.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 30.9 m -66.9 -24.8 33.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.614 -177.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.433 ' HB2' ' OD1' ' A' ' 107' ' ' ASP . 33.2 mt-10 -68.97 -54.21 16.54 Favored 'General case' 0 C--N 1.313 -0.994 0 C-N-CA 124.051 0.94 . . . . 0.0 109.357 -178.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -38.27 90.48 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.511 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.424 ' O ' ' HG2' ' A' ' 115' ' ' MET . 83.3 t80 -61.01 -54.04 49.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 O-C-N 123.61 0.569 . . . . 0.0 109.589 178.32 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.477 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -54.1 -48.64 70.49 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.729 0.643 . . . . 0.0 111.189 -179.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.407 ' HE3' ' HB2' ' A' ' 113' ' ' LYS . 37.9 ttmt -67.62 -45.43 75.42 Favored 'General case' 0 N--CA 1.441 -0.911 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.355 -176.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.407 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -66.9 -33.81 76.4 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.354 -0.216 . . . . 0.0 111.577 -179.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.7 mmm -63.05 -45.22 93.26 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.561 -0.291 . . . . 0.0 111.383 178.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.277 0.1 OUTLIER -72.57 -22.51 60.99 Favored 'General case' 0 C--N 1.313 -0.998 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 -177.239 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -99.77 -8.85 23.7 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 118.297 -1.361 . . . . 0.0 111.778 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -115.25 -51.89 2.69 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.333 0.494 . . . . 0.0 112.333 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.23 -22.33 28.72 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.672 0.749 . . . . 0.0 110.636 -173.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.428 ' HG3' ' HG2' ' A' ' 122' ' ' GLU . 58.6 tptt -106.98 120.52 47.76 Favored Pre-proline 0 C--N 1.291 -1.948 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -72.42 55.52 2.56 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.207 1.938 . . . . 0.0 114.283 -177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.428 ' HG2' ' HG3' ' A' ' 120' ' ' LYS . 33.5 mm-40 -83.78 -23.53 31.46 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-O 121.841 0.829 . . . . 0.0 108.981 175.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 22.7 tm0? -127.01 130.8 50.72 Favored 'General case' 0 N--CA 1.426 -1.662 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 175.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.416 ' HB3' ' NZ ' ' A' ' 124' ' ' LYS . 6.5 mtpm? -136.8 -63.64 0.61 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 121.306 0.574 . . . . 0.0 112.415 -174.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -61.23 103.35 0.28 Allowed 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 114.221 -1.354 . . . . 0.0 112.615 -169.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -115.39 -13.46 8.91 Favored Glycine 0 C--N 1.309 -0.924 0 N-CA-C 111.378 -0.689 . . . . 0.0 111.378 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -103.3 86.77 2.73 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 45.6 m -143.58 133.14 23.56 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.16 -39.84 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.125 0.266 . . . . 0.0 111.226 -179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 32.6 t70 42.62 -87.93 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 126.492 1.917 . . . . 0.0 114.374 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -151.31 171.79 16.91 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.77 0.795 . . . . 0.0 109.694 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -124.08 85.3 2.39 Favored 'General case' 0 N--CA 1.414 -2.265 1 N-CA-C 100.029 -4.063 . . . . 0.0 100.029 165.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.1 -25.98 68.34 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.147 -1.388 . . . . 0.0 114.327 -164.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 3.4 pm0 -70.31 162.51 28.4 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 177.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -73.02 82.96 1.25 Allowed 'General case' 0 C--N 1.311 -1.087 0 CA-C-O 121.505 0.669 . . . . 0.0 112.038 -178.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 76.99 159.12 0.21 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 126.815 2.046 . . . . 0.0 109.71 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -73.01 -17.23 61.47 Favored 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.794 0.807 . . . . 0.0 109.976 178.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 62.0 mtt 72.96 -81.96 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 125.676 1.591 . . . . 0.0 114.003 170.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 19.8 m 62.93 14.13 7.22 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.94 0.896 . . . . 0.0 112.397 -178.146 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.7 pp -99.55 -15.49 18.61 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.688 -177.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 . . . . . 0 C--O 1.25 1.104 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 177.636 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.2 t . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -104.84 -11.47 16.75 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 72.86 -16.78 0.44 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 125.535 1.534 . . . . 0.0 113.233 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mt -83.42 84.55 1.87 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.913 0 CA-C-O 121.67 0.747 . . . . 0.0 109.137 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.3 tt -133.14 80.36 1.88 Allowed 'General case' 0 N--CA 1.417 -2.08 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.47 104.51 16.49 Favored 'General case' 0 C--N 1.304 -1.41 0 CA-C-N 114.859 -1.064 . . . . 0.0 110.365 -177.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.5 m -85.22 -33.85 22.14 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -121.53 88.52 2.95 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.915 177.415 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -125.71 72.32 1.27 Allowed 'General case' 0 C--N 1.308 -1.217 0 CA-C-O 121.992 0.901 . . . . 0.0 108.825 172.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.6 t -137.9 112.09 8.86 Favored Pre-proline 0 C--N 1.304 -1.381 0 N-CA-C 106.831 -1.544 . . . . 0.0 106.831 -178.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -65.27 -67.95 0.04 OUTLIER 'Trans proline' 0 C--O 1.243 0.744 0 C-N-CA 121.8 1.667 . . . . 0.0 111.338 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.99 175.49 0.13 Allowed 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.682 1.193 . . . . 0.0 112.777 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 134.16 139.89 4.21 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.344 179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_endo -77.49 146.36 24.37 Favored 'Trans proline' 0 C--O 1.245 0.846 0 C-N-CA 122.609 2.206 . . . . 0.0 111.898 179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.76 -68.84 0.22 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.818 -179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 131.68 -162.45 23.78 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 -178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.59 8.07 7.8 Favored Glycine 0 C--N 1.312 -0.776 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.027 178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -70.77 -42.55 70.25 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.879 0.371 . . . . 0.0 110.398 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 26.9 mm-40 -129.58 127.54 40.88 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 173.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.2 t 64.74 82.65 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 O-C-N 124.284 0.99 . . . . 0.0 108.593 -172.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.522 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.6 t70 -93.73 121.58 35.31 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.288 178.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.432 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.4 pp -50.38 -41.59 52.08 Favored 'General case' 0 C--N 1.307 -1.241 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -177.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.0 -26.29 36.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.268 0.556 . . . . 0.0 111.088 -175.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.7 m -74.36 -37.25 63.54 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.838 179.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.4 p -91.8 -34.24 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.417 ' HG ' HG13 ' A' ' 25' ' ' VAL . 83.6 mt -117.37 109.98 17.47 Favored 'General case' 0 C--N 1.309 -1.166 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 -178.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 9.4 p -88.73 156.28 50.1 Favored Pre-proline 0 C--O 1.26 1.623 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.373 -176.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -52.0 -34.13 55.54 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 123.808 3.005 . . . . 0.0 113.26 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -66.17 -27.67 68.19 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.904 0.705 . . . . 0.0 112.904 -179.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.5 mt -79.91 -33.56 14.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-O 121.952 0.882 . . . . 0.0 108.853 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.53 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.9 mmt -86.8 -6.85 58.69 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.766 -1.106 . . . . 0.0 113.317 -174.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.44 -56.99 28.26 Favored Pre-proline 0 C--N 1.316 -0.891 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -178.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -73.77 -15.17 24.15 Favored 'Trans proline' 0 C--N 1.372 1.8 0 CA-C-N 120.249 1.124 . . . . 0.0 112.229 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 69.7 mt -79.28 -58.45 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.536 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.53 HD13 ' HB3' ' A' ' 31' ' ' MET . 8.9 mp -71.39 -16.15 62.39 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.89 -5.24 37.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.747 0.308 . . . . 0.0 111.455 178.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.478 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.2 t30 -98.64 124.22 43.31 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 120.839 0.352 . . . . 0.0 110.266 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.66 0.784 . . . . 0.0 112.739 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -64.54 -42.01 95.99 Favored 'General case' 0 C--O 1.269 2.112 0 CA-C-O 121.641 0.734 . . . . 0.0 111.035 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 37' ' ' ASN . 7.7 m -76.2 -33.03 23.33 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.396 -179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HB3' HD13 ' A' ' 54' ' ' LEU . 70.0 mt-30 -57.44 -40.37 78.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.813 177.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -56.16 -48.39 76.41 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -66.07 -30.1 70.56 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.2 mp -82.43 -24.65 34.22 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 39.4 mt -46.59 -47.83 49.03 Favored Pre-proline 0 N--CA 1.48 1.061 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 -178.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -64.66 -14.14 42.94 Favored 'Trans proline' 0 C--N 1.367 1.516 0 C-N-CA 121.948 1.765 . . . . 0.0 112.72 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.6 1.81 15.08 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.637 -175.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.491 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 56.9 tp -51.8 119.17 13.14 Favored Pre-proline 0 C--O 1.243 0.725 0 O-C-N 124.125 0.891 . . . . 0.0 110.85 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -66.61 146.34 79.02 Favored 'Trans proline' 0 C--O 1.253 1.239 0 C-N-CA 122.418 2.079 . . . . 0.0 111.054 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -61.52 129.31 40.54 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.676 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 100.64 -26.84 23.12 Favored Glycine 0 N--CA 1.441 -0.976 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.996 178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -90.85 163.24 14.48 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.218 0.532 . . . . 0.0 111.67 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.6 m -144.11 161.3 39.18 Favored 'General case' 0 C--N 1.292 -1.923 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 41' ' ' GLN . 88.0 mt -81.45 119.29 75.24 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 122.85 0.46 . . . . 0.0 110.968 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -83.14 132.15 6.07 Favored 'Trans proline' 0 N--CA 1.441 -1.616 0 C-N-CA 121.854 1.703 . . . . 0.0 109.501 171.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -84.84 -45.44 12.3 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -172.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.506 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 37.6 p -86.17 144.14 27.63 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.229 -178.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.83 -34.65 71.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.07 0.462 . . . . 0.0 110.603 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.59 -51.04 68.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.895 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 57' ' ' THR . 13.6 pt-20 -68.99 -27.05 65.35 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 -177.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 57' ' ' THR . 60.3 mt -58.8 -45.51 91.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.724 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 174.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.0 mm-40 -68.49 -33.91 74.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.163 0.506 . . . . 0.0 110.353 -179.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -75.21 -48.65 22.46 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.859 -175.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 36.4 m -81.1 -43.11 19.94 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.818 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HG23 ' A' ' 61' ' ' ILE . 64.9 mt -93.38 80.05 4.4 Favored 'General case' 0 N--CA 1.443 -0.791 0 CA-C-O 121.634 0.73 . . . . 0.0 109.259 -177.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.8 p -75.29 -72.23 0.32 Allowed 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.454 -179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.446 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 37.4 m -147.62 -58.35 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.774 -0.631 . . . . 0.0 110.687 177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.446 ' HD2' ' H ' ' A' ' 67' ' ' SER . 11.3 Cg_endo -55.4 -56.88 1.93 Allowed 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 122.124 1.882 . . . . 0.0 111.547 177.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -68.62 -25.11 64.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.109 179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -68.59 -39.44 80.91 Favored 'General case' 0 C--O 1.208 -1.096 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.353 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 67' ' ' SER . 54.6 mt-30 -60.38 -36.42 78.03 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.385 0.612 . . . . 0.0 109.446 176.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -68.12 -48.63 64.88 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.5 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.69 -36.94 76.4 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.284 0.564 . . . . 0.0 111.352 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 32.6 tp -74.29 -21.0 59.93 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.56 -47.37 69.6 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.857 -0.897 . . . . 0.0 110.857 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.6 ptt? -67.48 -31.74 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.4 t80 -61.19 -52.2 65.83 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.025 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 38.0 m -64.26 -32.84 74.58 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.471 -178.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.64 -46.2 73.15 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.845 0.355 . . . . 0.0 110.375 177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.48 -31.41 72.48 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 121.322 0.582 . . . . 0.0 110.401 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.535 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -68.96 -45.46 70.65 Favored 'General case' 0 C--O 1.212 -0.894 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.94 -31.41 72.49 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.387 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 18.0 m -73.16 -16.49 61.43 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 120.979 0.419 . . . . 0.0 110.93 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 82.65 0.4 90.02 Favored Glycine 0 N--CA 1.448 -0.543 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 -178.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -73.52 -28.69 62.03 Favored 'General case' 0 C--O 1.211 -0.944 0 CA-C-O 121.358 0.599 . . . . 0.0 110.254 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 37.9 tp -95.79 8.62 43.03 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.453 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.479 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -66.97 -70.53 1.1 Allowed Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.353 -176.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -58.08 -20.46 45.91 Favored 'Trans proline' 0 N--CA 1.479 0.619 0 C-N-CA 123.491 2.794 . . . . 0.0 112.525 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.436 ' HA ' HE21 ' A' ' 92' ' ' GLN . 8.3 mp -67.4 -22.38 65.55 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.04 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 mmt -72.54 -20.29 61.36 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.36 0.6 . . . . 0.0 110.74 178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -70.92 -25.99 63.0 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.436 HE21 ' HA ' ' A' ' 89' ' ' LEU . 44.6 mt-30 -72.61 -16.0 61.73 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.984 -178.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.559 ' HB2' HD13 ' A' ' 95' ' ' LEU . 52.6 m-85 -104.29 -0.51 28.2 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 120.978 0.418 . . . . 0.0 110.528 -178.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.72 29.39 67.58 Favored Glycine 0 N--CA 1.453 -0.177 0 CA-C-N 115.749 -0.659 . . . . 0.0 112.059 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.559 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.1 mp -69.54 155.83 92.8 Favored Pre-proline 0 C--N 1.315 -0.933 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.56 148.46 8.17 Favored 'Trans proline' 0 C--N 1.361 1.213 0 C-N-CA 124.001 3.134 . . . . 0.0 112.952 178.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.89 -37.72 83.17 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.157 179.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.402 ' HB2' ' HB1' ' A' ' 114' ' ' ALA . 48.4 mt-10 -62.59 -37.23 85.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.316 -0.857 . . . . 0.0 110.047 179.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -74.4 -50.83 16.94 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.205 -176.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.8 p -61.86 -35.86 70.47 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -178.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -61.99 -49.12 77.34 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 123.141 0.577 . . . . 0.0 110.479 177.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.85 92.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.864 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.479 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.89 -32.79 73.52 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.532 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -69.25 -39.41 78.48 Favored 'General case' 0 CA--C 1.497 -1.058 0 CA-C-O 120.95 0.405 . . . . 0.0 111.082 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -80.45 -23.76 40.02 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.624 -0.717 . . . . 0.0 111.348 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.535 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 97.92 23.01 14.09 Favored Glycine 0 N--CA 1.428 -1.863 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.862 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -97.13 114.35 26.02 Favored 'General case' 0 C--N 1.312 -1.058 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.29 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 34.3 m -77.05 -30.78 18.09 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.215 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -176.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.21 -35.57 31.14 Favored 'General case' 0 CA--C 1.504 -0.822 0 C-N-CA 119.486 -0.886 . . . . 0.0 110.336 -174.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.49 -39.98 92.55 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.89 176.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.469 ' O ' ' HG2' ' A' ' 115' ' ' MET . 91.6 t80 -63.0 -55.26 27.24 Favored 'General case' 0 CA--C 1.514 -0.43 0 O-C-N 123.872 0.732 . . . . 0.0 109.737 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -57.45 -40.15 77.85 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.528 -178.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.474 ' HA ' HE21 ' A' ' 116' ' ' GLN . 36.3 ttmt -67.71 -46.56 71.89 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.968 -179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 98' ' ' GLU . . . -63.82 -38.01 89.49 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.545 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.469 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 97.5 mmm -58.36 -58.6 7.78 Favored 'General case' 0 C--N 1.324 -0.529 0 O-C-N 123.293 0.37 . . . . 0.0 110.903 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.585 ' O ' ' HB3' ' A' ' 120' ' ' LYS 0.316 3.5 pp0? -75.45 -5.84 47.1 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -177.832 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -93.69 -10.54 34.08 Favored 'General case' 0 C--N 1.315 -0.926 0 O-C-N 121.44 -0.788 . . . . 0.0 111.467 173.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -114.66 -52.97 2.68 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.079 0.466 . . . . 0.0 111.09 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -121.61 83.63 2.12 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 116' ' ' GLN . 19.8 pttp -105.97 120.89 47.52 Favored Pre-proline 0 C--N 1.29 -2.013 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.22 -176.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.1 8.59 4.54 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 122.408 2.072 . . . . 0.0 112.566 -178.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.89 -26.09 25.8 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -160.21 130.26 5.34 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -113.9 161.33 17.76 Favored 'General case' 0 C--O 1.252 1.21 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.297 -173.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 68.6 -73.86 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 125.243 1.417 . . . . 0.0 112.475 178.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 98.41 146.67 20.98 Favored Glycine 0 N--CA 1.424 -2.14 0 N-CA-C 109.841 -1.304 . . . . 0.0 109.841 -176.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -133.73 164.88 26.24 Favored 'General case' 0 C--N 1.283 -2.308 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 7.3 p -66.36 -77.63 0.06 Allowed 'General case' 0 N--CA 1.418 -2.069 0 O-C-N 124.136 0.898 . . . . 0.0 111.753 -178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? 54.43 36.49 25.66 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 -177.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -63.31 -52.57 61.36 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.715 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 57.68 -174.06 0.08 Allowed 'General case' 0 C--O 1.246 0.902 0 C-N-CA 124.119 0.967 . . . . 0.0 112.256 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 20.3 tptm -126.89 81.8 2.04 Favored 'General case' 0 N--CA 1.418 -2.073 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 177.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -89.33 -55.44 3.66 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 106.703 -1.591 . . . . 0.0 106.703 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -74.82 108.76 7.77 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.577 -1.638 . . . . 0.0 106.577 171.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -72.83 -61.05 1.94 Allowed 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 53.82 91.16 0.03 OUTLIER 'General case' 0 C--O 1.239 0.517 0 C-N-CA 125.393 1.477 . . . . 0.0 112.224 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -102.92 128.27 49.79 Favored 'General case' 0 C--N 1.29 -2.002 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . 0.488 ' HB2' ' O ' ' A' ' 141' ' ' ASP . 25.9 ptt? -78.93 87.33 4.76 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-O 122.299 1.047 . . . . 0.0 109.267 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -107.94 -47.38 3.59 Favored 'General case' 0 C--N 1.297 -1.678 0 CA-C-N 114.776 -1.102 . . . . 0.0 109.342 -177.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 4.9 tt -80.43 -47.28 14.6 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 178.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.488 ' O ' ' HB2' ' A' ' 138' ' ' MET . 37.2 t70 . . . . . 0 N--CA 1.434 -1.23 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.66 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.428 ' HA ' ' OD1' ' A' ' 63' ' ' ASN . 6.2 m . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 27.5 p-10 -93.32 133.9 36.09 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 120.906 0.384 . . . . 0.0 110.071 178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -89.21 -30.79 18.28 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 174.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 18.9 pt -80.48 89.56 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.418 -2.066 0 CA-C-O 122.736 1.255 . . . . 0.0 109.603 174.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 60.1 mt -85.29 91.89 8.29 Favored 'General case' 0 C--N 1.284 -2.269 0 CA-C-N 114.022 -1.445 . . . . 0.0 108.787 -177.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.98 15.78 24.97 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.574 -177.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.1 p -88.31 -8.03 55.78 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.989 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 87.4 mtp 69.62 23.51 5.84 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.176 0.99 . . . . 0.0 111.275 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -96.95 141.3 30.3 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -103.51 107.16 55.19 Favored Pre-proline 0 C--N 1.312 -1.046 0 N-CA-C 108.431 -0.952 . . . . 0.0 108.431 169.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -68.49 -46.93 1.67 Allowed 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.174 1.916 . . . . 0.0 111.058 178.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.46 61.6 6.68 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.577 0.703 . . . . 0.0 110.282 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -120.0 102.97 0.91 Allowed Glycine 0 N--CA 1.437 -1.264 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -62.99 120.86 8.52 Favored 'Trans proline' 0 C--O 1.248 0.991 0 C-N-CA 123.104 2.536 . . . . 0.0 112.75 -178.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -157.69 104.44 1.96 Allowed 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -143.67 133.74 5.52 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.201 -176.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -114.64 170.96 13.48 Favored Glycine 0 C--N 1.298 -1.56 0 N-CA-C 110.661 -0.976 . . . . 0.0 110.661 178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -90.38 173.04 8.32 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 117.074 0.437 . . . . 0.0 110.839 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 68.19 -88.68 0.03 OUTLIER 'General case' 0 C--O 1.243 0.755 0 C-N-CA 124.684 1.194 . . . . 0.0 111.94 -178.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.505 HG21 ' HB3' ' A' ' 109' ' ' GLU . 21.5 t -121.82 96.5 4.18 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.62 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.488 ' O ' HG12 ' A' ' 25' ' ' VAL . 12.0 t70 -99.93 98.9 9.62 Favored 'General case' 0 C--N 1.291 -1.975 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 173.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . 0.278 1.4 pp -53.52 -38.3 63.62 Favored 'General case' 0 N--CA 1.434 -1.263 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -171.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -78.56 -30.39 46.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.063 0.459 . . . . 0.0 111.247 -177.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.6 t -75.71 -36.39 60.01 Favored 'General case' 0 C--O 1.251 1.148 0 CA-C-O 121.267 0.556 . . . . 0.0 110.117 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 21' ' ' ASP . 9.0 p -84.03 -45.15 18.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.947 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.54 -179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.419 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.6 mt -113.17 107.97 16.65 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 -179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -94.26 158.65 35.53 Favored Pre-proline 0 C--N 1.291 -1.964 0 N-CA-C 112.883 0.698 . . . . 0.0 112.883 -172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.3 -27.01 55.25 Favored 'Trans proline' 0 C--N 1.375 1.932 0 C-N-CA 123.775 2.983 . . . . 0.0 113.213 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -64.4 -35.74 81.88 Favored 'General case' 0 C--N 1.321 -0.66 0 C-N-CA 123.46 0.704 . . . . 0.0 111.325 178.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 41.6 mt -84.36 -39.68 14.77 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-O 121.649 0.738 . . . . 0.0 109.499 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.5 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.8 mmt -80.9 -7.25 59.44 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -175.045 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.79 -55.83 39.32 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 113.569 0.952 . . . . 0.0 113.569 -178.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -70.62 -22.84 27.6 Favored 'Trans proline' 0 C--N 1.372 1.77 0 C-N-CA 121.378 1.385 . . . . 0.0 112.421 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.4 mt -76.52 -55.56 10.65 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.834 -176.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.8 mp -71.33 -15.13 62.38 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -177.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.95 -3.38 35.19 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.159 0.504 . . . . 0.0 110.782 177.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.536 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.5 t30 -94.02 116.49 28.93 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.43 -22.96 65.49 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -176.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 14.3 t70 -73.32 -29.05 62.42 Favored 'General case' 0 C--O 1.259 1.59 0 CA-C-O 121.586 0.708 . . . . 0.0 110.848 -178.252 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.1 m -78.53 -34.67 18.16 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 175.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -60.9 -34.14 74.2 Favored 'General case' 0 C--O 1.215 -0.72 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.734 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 12.3 tp10 -55.21 -48.43 73.88 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 123.88 0.872 . . . . 0.0 109.741 174.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -69.23 -26.84 65.0 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 177.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.5 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.3 mp -84.52 -22.22 30.26 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.1 mt -46.0 -50.63 35.31 Favored Pre-proline 0 N--CA 1.486 1.342 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -64.24 -14.45 43.91 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 121.945 1.763 . . . . 0.0 113.045 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 46.4 m-85 -113.13 6.31 17.48 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 116.739 -0.209 . . . . 0.0 111.215 -174.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.449 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 34.0 tp -53.34 119.15 16.39 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.505 0.722 . . . . 0.0 111.345 -178.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -62.25 162.88 21.85 Favored 'Trans proline' 0 C--N 1.355 0.897 0 C-N-CA 123.26 2.64 . . . . 0.0 112.346 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.5 m -70.98 119.64 15.39 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.195 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 82.39 20.65 61.85 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.068 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -94.39 170.88 9.17 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.0 m -143.44 158.33 43.73 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 98.7 mt -106.16 102.54 40.5 Favored Pre-proline 0 C--N 1.292 -1.913 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.813 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.405 ' HB3' ' HG3' ' A' ' 60' ' ' GLU . 7.6 Cg_exo -71.65 131.91 19.43 Favored 'Trans proline' 0 N--CA 1.45 -1.072 0 C-N-CA 121.844 1.696 . . . . 0.0 110.088 177.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -86.16 -38.54 17.6 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 113.255 0.835 . . . . 0.0 113.255 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.432 ' O ' HG13 ' A' ' 61' ' ' ILE . 52.2 p -104.64 154.37 20.05 Favored 'General case' 0 C--N 1.311 -1.099 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.67 -179.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.435 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.73 -34.54 67.61 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.363 0.601 . . . . 0.0 110.512 178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -56.38 -60.64 3.23 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.973 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.405 ' HG3' ' HB3' ' A' ' 55' ' ' PRO . 11.4 pt-20 -67.16 -23.55 65.79 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.293 -177.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 57' ' ' THR . 69.0 mt -62.35 -43.64 98.34 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.346 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 173.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.2 mm-40 -68.94 -34.45 75.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.355 0.597 . . . . 0.0 110.146 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.428 ' OD1' ' HA ' ' A' ' 1' ' ' SER . 45.0 m-80 -74.81 -44.93 46.74 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.688 -178.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 31.1 m -91.75 -35.15 14.3 Favored 'General case' 0 CA--C 1.553 1.072 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 60.1 mt -109.66 68.44 0.67 Allowed 'General case' 0 C--N 1.311 -1.072 0 O-C-N 121.044 -1.035 . . . . 0.0 109.727 -176.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.1 m -84.62 -51.73 6.63 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.628 -179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.9 m -147.17 -67.3 0.02 OUTLIER Pre-proline 0 CA--C 1.55 0.968 0 CA-C-O 118.383 -0.817 . . . . 0.0 112.664 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -56.09 -56.63 1.97 Allowed 'Trans proline' 0 C--N 1.383 2.345 0 C-N-CA 121.954 1.769 . . . . 0.0 112.196 -178.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -72.82 -21.11 61.02 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.693 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -68.81 -43.04 76.44 Favored 'General case' 0 C--O 1.207 -1.147 0 C-N-CA 120.346 -0.541 . . . . 0.0 109.762 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -63.66 -36.07 82.62 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.269 0.556 . . . . 0.0 110.331 178.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -68.46 -49.69 57.94 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.852 178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.12 -36.84 84.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.429 0.633 . . . . 0.0 111.023 178.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 26.8 tp -72.59 -20.75 61.24 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.41 -38.93 57.92 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.8 -0.637 . . . . 0.0 111.629 176.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.48 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 25.6 ptt? -73.58 -30.93 63.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.378 0.609 . . . . 0.0 109.372 176.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -61.02 -49.26 78.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.645 -1.161 . . . . 0.0 108.187 174.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.7 t -55.28 -43.13 74.46 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.44 1.096 . . . . 0.0 110.617 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.39 -44.19 88.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.782 0.325 . . . . 0.0 111.358 -179.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.32 72.45 Favored 'General case' 0 C--O 1.251 1.158 0 CA-C-O 121.093 0.473 . . . . 0.0 110.756 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.3 tt -69.37 -50.35 47.01 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 178.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.64 -29.94 69.56 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.313 0.577 . . . . 0.0 111.02 179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 33.3 t -76.33 -12.42 60.06 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.254 178.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 76.96 7.0 86.44 Favored Glycine 0 C--N 1.339 0.735 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.174 179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -84.13 -21.1 31.52 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.318 0.58 . . . . 0.0 109.846 -177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 19.1 tp -98.28 0.44 45.64 Favored 'General case' 0 C--N 1.309 -1.165 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.591 -178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.61 -58.91 11.45 Favored Glycine 0 CA--C 1.532 1.11 0 CA-C-N 115.134 -0.939 . . . . 0.0 113.669 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -54.46 -32.21 72.19 Favored 'Trans proline' 0 C--N 1.367 1.522 0 C-N-CA 123.445 2.763 . . . . 0.0 112.778 179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -62.71 -38.87 92.18 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.482 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.4 mmt -72.76 -24.33 60.94 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.204 0.526 . . . . 0.0 111.046 -178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.8 t -69.29 -39.02 78.56 Favored 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.307 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -82.47 -9.61 59.36 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.556 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -88.02 -5.63 58.4 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.328 -0.549 . . . . 0.0 109.91 173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.87 35.51 84.96 Favored Glycine 0 N--CA 1.448 -0.503 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 5.0 mp -71.47 157.47 89.87 Favored Pre-proline 0 C--N 1.311 -1.099 0 C-N-CA 122.144 0.178 . . . . 0.0 111.417 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -47.96 145.28 10.57 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 123.482 2.788 . . . . 0.0 111.836 178.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.35 72.16 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -174.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -71.95 -31.05 65.93 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.18 0.514 . . . . 0.0 110.251 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.42 -46.66 59.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.28 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.9 p -67.73 -35.78 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.85 -50.09 74.47 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 174.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.59 -37.03 82.39 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.806 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.62 -29.59 68.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.126 0.488 . . . . 0.0 111.57 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 34.2 m-80 -81.38 -37.04 28.83 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.061 0.457 . . . . 0.0 110.801 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -78.5 -23.39 46.36 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.433 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 94.32 36.17 5.76 Favored Glycine 0 N--CA 1.429 -1.831 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.841 175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -115.31 114.52 25.27 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 17.7 m -77.23 -26.31 15.57 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.138 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -175.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HB3' HG21 ' A' ' 20' ' ' VAL . 12.9 pt-20 -81.11 -40.48 24.01 Favored 'General case' 0 CA--C 1.5 -0.979 0 C-N-CA 119.485 -0.886 . . . . 0.0 110.875 -175.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.27 -36.48 83.8 Favored 'General case' 0 N--CA 1.444 -0.761 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -62.69 -56.46 17.5 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.689 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.599 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -58.45 -41.91 86.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.373 -177.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 48.8 tttm -64.41 -55.03 23.72 Favored 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.089 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.92 -36.79 83.05 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -176.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 23.2 ttt -61.65 -59.3 5.4 Favored 'General case' 0 N--CA 1.439 -0.996 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -176.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.599 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.271 3.6 pp0? -73.51 -22.8 60.03 Favored 'General case' 0 C--O 1.2 -1.515 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -176.306 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -73.68 -22.17 60.02 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.485 177.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -98.16 -36.63 10.0 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.239 177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -65.87 -43.67 87.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 176.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -116.15 105.38 50.99 Favored Pre-proline 0 N--CA 1.431 -1.408 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 177.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.6 49.71 0.52 Allowed 'Trans proline' 0 CA--C 1.543 0.947 0 C-N-CA 123.446 2.764 . . . . 0.0 112.712 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -55.75 -25.05 38.74 Favored 'General case' 0 CA--C 1.549 0.923 0 N-CA-C 114.336 1.235 . . . . 0.0 114.336 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -141.33 166.39 24.9 Favored 'General case' 0 C--O 1.241 0.608 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.385 172.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 13.4 ptmm? -148.05 140.34 24.3 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.64 -16.76 21.84 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-O 121.283 0.563 . . . . 0.0 110.27 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 130.45 118.24 2.0 Favored Glycine 0 N--CA 1.423 -2.207 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.069 176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.463 ' O ' ' HB ' ' A' ' 128' ' ' THR . 9.2 t70 -81.33 146.7 30.23 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 106.932 -1.507 . . . . 0.0 106.932 177.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 127' ' ' ASP . 95.8 m 77.8 -20.23 0.39 Allowed 'General case' 0 CA--C 1.56 1.349 0 C-N-CA 123.252 0.621 . . . . 0.0 112.307 177.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 65.66 83.42 0.17 Allowed 'General case' 0 CA--C 1.506 -0.726 0 C-N-CA 124.374 1.07 . . . . 0.0 109.374 -174.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -113.07 135.21 54.05 Favored 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.244 178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 38.8 mttp 67.83 71.08 0.33 Allowed 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.379 1.072 . . . . 0.0 108.433 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -79.82 -26.11 40.59 Favored 'General case' 0 C--N 1.305 -1.354 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -117.3 151.71 36.4 Favored 'General case' 0 N--CA 1.427 -1.615 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 -179.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -84.16 140.54 31.68 Favored 'General case' 0 C--N 1.298 -1.659 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.24 -179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -83.59 -37.07 23.4 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.077 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 67.14 111.76 0.04 OUTLIER 'General case' 0 C--O 1.245 0.819 0 C-N-CA 124.589 1.156 . . . . 0.0 111.64 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -79.56 -69.39 0.58 Allowed 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.541 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 53.4 ttm -154.92 102.48 2.34 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-O 121.436 0.636 . . . . 0.0 111.815 179.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.5 m -91.0 98.18 11.62 Favored 'General case' 0 N--CA 1.427 -1.615 0 CA-C-N 115.136 -0.938 . . . . 0.0 108.719 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 62.1 tp -177.35 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 -178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.3 t70 . . . . . 0 C--N 1.31 -1.125 0 CA-C-N 114.699 -1.137 . . . . 0.0 108.5 179.034 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.9 m . . . . . 0 N--CA 1.443 -0.776 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 46.3 t30 74.55 149.35 0.1 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.166 0.986 . . . . 0.0 109.683 -178.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.89 -47.35 83.69 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 121.2 -0.2 . . . . 0.0 110.808 -178.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 80.2 mt 69.8 -59.24 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.268 0 C-N-CA 125.275 1.43 . . . . 0.0 112.164 178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.9 tp 72.33 -51.46 0.7 Allowed 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.424 1.49 . . . . 0.0 112.53 177.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.78 14.31 7.21 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.587 1.155 . . . . 0.0 112.571 176.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.5 m -99.05 156.84 16.72 Favored 'General case' 0 C--N 1.308 -1.237 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -178.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 44.4 ttp 71.17 19.69 5.38 Favored 'General case' 0 N--CA 1.482 1.141 0 CA-C-O 122.906 1.336 . . . . 0.0 109.229 -177.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -146.46 87.11 1.7 Allowed 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.9 p -145.18 93.36 5.48 Favored Pre-proline 0 C--N 1.313 -0.983 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -172.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.517 ' HD2' ' OE1' ' A' ' 72' ' ' GLN . 26.5 Cg_exo -66.67 -37.38 21.68 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.167 1.911 . . . . 0.0 110.12 168.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 70.86 158.32 0.18 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.311 1.444 . . . . 0.0 113.15 177.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 171.05 108.78 0.21 Allowed Glycine 0 N--CA 1.436 -1.358 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -79.44 -22.87 7.76 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 122.04 1.827 . . . . 0.0 112.192 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.51 ' HB3' HD21 ' A' ' 22' ' ' LEU . . . 60.08 19.56 8.77 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.575 1.15 . . . . 0.0 111.492 -178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -159.6 -113.82 0.35 Allowed Glycine 0 N--CA 1.425 -2.057 0 N-CA-C 106.243 -2.743 . . . . 0.0 106.243 178.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.95 -66.69 0.54 Allowed Glycine 0 C--N 1.305 -1.176 0 C-N-CA 119.308 -1.425 . . . . 0.0 113.862 172.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -70.43 -49.05 52.83 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.931 0.872 . . . . 0.0 109.182 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.82 168.9 18.67 Favored 'General case' 0 N--CA 1.416 -2.151 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 177.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.4 t 65.95 89.47 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.111 0 O-C-N 124.812 1.32 . . . . 0.0 111.723 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -97.1 98.63 10.21 Favored 'General case' 0 CA--C 1.492 -1.284 0 N-CA-C 106.918 -1.512 . . . . 0.0 106.918 174.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -53.19 -35.47 59.89 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -174.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.89 -22.88 49.07 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -173.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 21.1 p -84.55 -33.27 23.48 Favored 'General case' 0 C--N 1.314 -0.969 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.177 177.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -85.67 -40.21 14.44 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.706 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.432 ' HB2' HD21 ' A' ' 74' ' ' LEU . 92.9 mt -113.09 113.14 25.0 Favored 'General case' 0 CA--C 1.501 -0.94 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 177.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 2.4 p -100.36 159.13 30.56 Favored Pre-proline 0 C--N 1.283 -2.316 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.892 -178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.17 -33.75 85.35 Favored 'Trans proline' 0 C--N 1.374 1.889 0 C-N-CA 123.309 2.673 . . . . 0.0 112.367 -176.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.454 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -53.23 -36.59 61.2 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.823 0.849 . . . . 0.0 111.619 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.454 HG13 ' HG3' ' A' ' 29' ' ' GLU . 30.5 mt -85.17 -38.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.81 0.814 . . . . 0.0 109.864 -178.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.428 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.9 mmt -73.78 -27.8 61.33 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.066 -0.97 . . . . 0.0 113.148 -174.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.434 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -49.45 -55.89 19.62 Favored Pre-proline 0 CA--C 1.556 1.175 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -176.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -69.23 -18.6 39.42 Favored 'Trans proline' 0 C--N 1.367 1.538 0 CA-C-N 120.689 1.282 . . . . 0.0 112.842 -179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.4 mt -82.35 -53.71 11.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.923 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -69.82 -13.89 62.49 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.49 -15.05 63.18 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.122 176.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.519 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.2 t-20 -85.19 126.71 33.87 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -26.14 68.56 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.345 0.658 . . . . 0.0 112.617 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.473 ' OD1' HD11 ' A' ' 89' ' ' LEU . 10.2 t70 -72.81 -38.61 67.12 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.19 -177.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.519 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.7 m -70.15 -33.91 56.82 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.855 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.492 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.5 mt-30 -61.96 -35.55 78.8 Favored 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.429 176.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -68.56 -36.61 79.0 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -70.53 -29.79 66.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.303 176.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -83.75 -16.48 44.66 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.3 mt -48.86 -51.7 52.38 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.405 1.632 . . . . 0.0 115.405 -179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -65.83 -10.3 26.26 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 121.793 1.662 . . . . 0.0 112.843 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -113.11 -6.15 13.69 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.348 . . . . 0.0 110.652 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.496 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -58.38 116.34 14.63 Favored Pre-proline 0 C--O 1.246 0.903 0 C-N-CA 124.921 1.288 . . . . 0.0 110.482 -178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.4 157.53 30.79 Favored 'Trans proline' 0 C--O 1.241 0.671 0 C-N-CA 122.915 2.41 . . . . 0.0 112.434 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 18.5 m -71.82 118.42 14.65 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.269 -178.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.15 4.43 62.94 Favored Glycine 0 N--CA 1.434 -1.435 0 C-N-CA 120.783 -0.723 . . . . 0.0 111.386 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -86.22 178.91 7.03 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.3 m -151.3 162.79 40.27 Favored 'General case' 0 C--N 1.284 -2.262 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.492 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.1 mt -107.99 101.55 41.69 Favored Pre-proline 0 C--N 1.296 -1.724 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.573 179.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -70.66 133.23 23.46 Favored 'Trans proline' 0 N--CA 1.443 -1.453 0 C-N-CA 121.8 1.667 . . . . 0.0 109.82 177.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -81.07 -57.36 3.56 Favored 'General case' 0 C--N 1.303 -1.42 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 -172.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.452 ' O ' HG13 ' A' ' 61' ' ' ILE . 62.3 p -87.63 158.72 18.79 Favored 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 121.109 -0.237 . . . . 0.0 110.929 -178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.524 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.94 -37.96 84.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.784 0.325 . . . . 0.0 110.824 -179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -59.92 -52.03 67.17 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.142 -179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.72 -26.69 67.13 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.493 -177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 57' ' ' THR . 79.0 mt -62.06 -51.44 72.42 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.428 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 174.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 9.7 mm100 -63.52 -36.32 83.4 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.905 -178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -69.54 -44.6 70.62 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.472 -178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 11.0 m -89.53 -47.68 7.82 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.115 0.483 . . . . 0.0 112.04 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.2 mt -92.45 93.61 8.67 Favored 'General case' 0 N--CA 1.427 -1.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.515 -173.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 11.0 t -138.07 148.41 45.01 Favored 'General case' 0 N--CA 1.405 -2.678 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.468 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.343 49.1 m 45.5 -97.69 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.208 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 178.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.81 -48.44 2.03 Favored 'Trans proline' 0 C--N 1.397 3.098 0 CA-C-N 122.583 1.958 . . . . 0.0 112.297 -176.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -70.52 -26.72 63.71 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.365 -175.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -70.06 -37.47 75.52 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.57 177.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 67' ' ' SER . 48.1 mt-30 -64.89 -32.64 74.45 Favored 'General case' 0 C--O 1.217 -0.642 0 CA-C-O 121.18 0.514 . . . . 0.0 109.761 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.517 ' OE1' ' HD2' ' A' ' 11' ' ' PRO . 14.6 mt-30 -71.03 -48.03 55.26 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.562 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.87 -38.1 85.68 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.953 179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.432 HD21 ' HB2' ' A' ' 26' ' ' LEU . 31.7 tp -75.4 -21.88 57.89 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.452 0.644 . . . . 0.0 109.471 178.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.92 -39.67 74.77 Favored Glycine 0 N--CA 1.44 -1.091 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.385 175.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.496 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -73.51 -33.0 64.57 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 176.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -60.22 -54.22 48.38 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.775 176.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 34.4 p -66.16 -30.81 71.36 Favored 'General case' 0 N--CA 1.437 -1.113 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.608 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.53 -42.46 91.98 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 120.829 0.347 . . . . 0.0 110.65 177.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.27 -34.28 70.56 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.008 0.432 . . . . 0.0 110.109 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.46 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -61.95 -52.4 64.21 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.291 -0.868 . . . . 0.0 108.699 177.303 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.444 ' HA ' ' O ' ' A' ' 106' ' ' GLY . . . -61.0 -26.17 67.41 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.193 0.597 . . . . 0.0 111.539 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 36.0 t -74.35 -20.8 59.96 Favored 'General case' 0 N--CA 1.435 -1.205 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.051 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 89.88 -13.76 63.62 Favored Glycine 0 C--N 1.334 0.456 0 C-N-CA 121.16 -0.543 . . . . 0.0 112.105 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -73.68 -14.51 61.16 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.23 0.538 . . . . 0.0 111.883 -177.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.8 tp -105.28 8.68 33.95 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-O 121.603 0.716 . . . . 0.0 109.421 -178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.67 -64.9 3.05 Favored Glycine 0 CA--C 1.531 1.08 0 CA-C-N 115.287 -0.869 . . . . 0.0 114.006 -178.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -51.75 -30.8 39.01 Favored 'Trans proline' 0 C--N 1.362 1.287 0 C-N-CA 124.109 3.206 . . . . 0.0 113.813 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.473 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.9 mm? -60.88 -29.15 69.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.285 -178.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.0 mmt -69.85 -22.76 63.24 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.213 0.53 . . . . 0.0 111.923 -176.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 53.6 t -72.07 -28.4 63.3 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -80.18 0.52 32.05 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.43 -0.804 . . . . 0.0 111.407 -176.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 72.9 m-85 -113.97 -1.78 13.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.008 0.432 . . . . 0.0 110.604 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.23 59.41 Favored Glycine 0 C--O 1.224 -0.475 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.06 -178.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.5 mp -77.02 155.96 82.43 Favored Pre-proline 0 C--N 1.305 -1.33 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -52.66 154.63 11.85 Favored 'Trans proline' 0 C--O 1.248 1.018 0 C-N-CA 123.895 3.063 . . . . 0.0 112.72 176.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.43 -40.2 90.2 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.03 179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 mm-40 -60.38 -43.34 96.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.463 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -51.13 50.2 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.504 -178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.5 p -65.97 -36.19 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -177.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.424 ' OE2' ' HE2' ' A' ' 105' ' ' LYS . 8.6 tp10 -65.71 -45.74 81.59 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 178.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.74 -38.74 89.1 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.976 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.57 -32.24 73.45 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.437 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -73.89 -39.88 63.57 Favored 'General case' 0 CA--C 1.499 -1.009 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.87 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.424 ' HE2' ' OE2' ' A' ' 101' ' ' GLU . 74.4 mmtt -74.29 -23.8 59.15 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.231 0.539 . . . . 0.0 110.143 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 91.23 21.89 33.93 Favored Glycine 0 N--CA 1.424 -2.106 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.672 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -91.76 101.52 14.12 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.6 m -67.03 -30.94 51.23 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-N 115.38 -0.827 . . . . 0.0 113.176 -175.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -81.37 -38.66 26.26 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 120.122 -0.631 . . . . 0.0 111.387 -176.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.3 -36.7 84.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -65.51 -50.07 66.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.753 177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -60.31 -44.13 95.73 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.276 -177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -61.71 -53.05 61.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.151 -0.931 . . . . 0.0 109.754 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.93 -36.27 80.89 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.54 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 119' ' ' ALA . 58.3 tpp -62.37 -58.51 7.39 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.974 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.266 3.9 pp0? -66.75 -19.52 65.77 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -90.39 -18.54 25.29 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.162 177.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -102.82 -56.6 2.2 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.419 ' HB3' ' SD ' ' A' ' 115' ' ' MET . . . -107.7 83.77 1.85 Allowed 'General case' 0 C--N 1.31 -1.149 0 CA-C-O 122.2 1.0 . . . . 0.0 110.712 -172.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.492 ' HG3' ' HB2' ' A' ' 122' ' ' GLU . 16.6 tppt? -111.89 104.11 55.77 Favored Pre-proline 0 C--N 1.276 -2.618 0 CA-C-N 114.036 -1.438 . . . . 0.0 110.038 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -76.91 53.32 4.1 Favored 'Trans proline' 0 N--CA 1.482 0.814 0 C-N-CA 123.557 2.838 . . . . 0.0 111.28 179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HB2' ' HG3' ' A' ' 120' ' ' LYS . 0.9 OUTLIER -63.89 -67.79 0.4 Allowed 'General case' 0 N--CA 1.428 -1.574 0 C-N-CA 125.218 1.407 . . . . 0.0 111.011 -176.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.497 ' CD ' ' H ' ' A' ' 124' ' ' LYS 0.498 0.0 OUTLIER 29.88 -105.63 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 116.594 2.072 . . . . 0.0 116.594 -175.244 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.525 ' HB2' ' O ' ' A' ' 127' ' ' ASP . 0.0 OUTLIER -173.54 105.42 0.13 Allowed 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.553 0.741 . . . . 0.0 109.996 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -103.59 -50.89 3.32 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.042 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -113.05 10.02 24.96 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.291 -175.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . 0.525 ' O ' ' HB2' ' A' ' 124' ' ' LYS . 7.4 t70 -144.85 177.16 8.93 Favored 'General case' 0 C--N 1.308 -1.236 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.8 m -106.36 -32.95 7.91 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt 49.02 78.91 0.08 Allowed 'General case' 0 C--O 1.241 0.635 0 C-N-CA 124.256 1.023 . . . . 0.0 112.851 -177.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -156.77 140.95 16.46 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -112.49 124.76 53.23 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -143.69 -29.08 0.52 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.995 168.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -131.78 96.92 4.05 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 120.993 0.425 . . . . 0.0 111.571 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -137.2 112.64 9.31 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 172.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 72.84 -70.01 0.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.023 1.329 . . . . 0.0 110.592 -177.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -155.32 177.23 11.59 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 -177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -100.09 148.97 23.99 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.3 ptm -72.4 88.12 1.19 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.725 1.25 . . . . 0.0 111.585 -176.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 3.0 p -110.94 -68.09 0.95 Allowed 'General case' 0 C--N 1.285 -2.208 0 CA-C-N 114.506 -1.225 . . . . 0.0 111.282 -176.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.0 mp -81.57 -26.77 34.71 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 122.115 0.96 . . . . 0.0 108.925 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.264 1.861 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.483 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' OD1' HG12 ' A' ' 4' ' ' ILE . 45.3 t30 67.29 96.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.385 1.074 . . . . 0.0 112.504 178.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -132.5 72.67 1.5 Allowed 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.889 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.427 HG12 ' OD1' ' A' ' 2' ' ' ASN . 34.9 pt -129.31 5.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.131 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.879 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.55 120.61 30.05 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.09 116.21 32.19 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.286 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -100.3 -105.43 0.23 Allowed 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 178.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 27.2 ttt -95.66 -43.33 7.96 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 168.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -82.1 143.92 31.15 Favored 'General case' 0 N--CA 1.435 -1.223 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.6 p -129.95 101.42 18.23 Favored Pre-proline 0 C--N 1.291 -1.962 0 CA-C-O 121.046 0.451 . . . . 0.0 110.903 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -73.05 -42.09 1.12 Allowed 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.094 1.196 . . . . 0.0 110.077 176.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 179.79 -177.47 0.36 Allowed 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.722 -1.585 . . . . 0.0 106.722 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.95 179.03 18.43 Favored Glycine 0 N--CA 1.431 -1.698 0 N-CA-C 109.841 -1.303 . . . . 0.0 109.841 178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -84.93 91.31 0.75 Allowed 'Trans proline' 0 N--CA 1.437 -1.84 0 C-N-CA 122.238 1.959 . . . . 0.0 111.241 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -82.23 121.14 26.26 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.828 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.15 -75.88 1.87 Allowed Glycine 0 N--CA 1.433 -1.548 0 N-CA-C 111.179 -0.768 . . . . 0.0 111.179 -179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.8 26.73 21.58 Favored Glycine 0 N--CA 1.439 -1.137 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.594 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 65.77 173.34 0.23 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.229 1.012 . . . . 0.0 112.68 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -91.58 -23.45 19.89 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 47.0 t -100.93 96.66 4.95 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 176.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.497 ' O ' HG12 ' A' ' 25' ' ' VAL . 28.3 t70 -89.83 116.45 27.93 Favored 'General case' 0 CA--C 1.482 -1.657 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.423 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -51.19 -39.31 56.2 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 114.54 1.311 . . . . 0.0 114.54 -178.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.423 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -82.19 -25.85 33.9 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.953 0.406 . . . . 0.0 111.755 -174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 28.7 t -75.78 -39.66 56.59 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.117 0.484 . . . . 0.0 109.905 178.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.497 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.8 p -84.29 -35.09 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.4 HD13 ' CE ' ' A' ' 31' ' ' MET . 82.0 mt -117.2 111.27 19.22 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.0 p -90.76 161.03 37.17 Favored Pre-proline 0 C--N 1.305 -1.329 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 -174.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -54.96 -37.1 93.64 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.641 2.894 . . . . 0.0 114.135 -176.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -65.11 -38.02 89.36 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 61.9 mt -66.97 -35.87 75.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.732 0.777 . . . . 0.0 109.555 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.495 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.9 mmt -87.56 -7.2 57.83 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.148 -176.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.507 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -61.39 -55.71 40.6 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -70.98 -20.04 29.57 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 121.494 1.463 . . . . 0.0 112.455 -179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.5 mt -79.16 -57.03 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.146 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.7 mp -73.26 -9.03 58.28 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -177.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.54 -6.26 57.95 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.144 0.497 . . . . 0.0 110.049 175.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.545 ' O ' HG22 ' A' ' 40' ' ' VAL . 42.9 t30 -92.24 113.65 25.98 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.529 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -51.23 -34.55 32.75 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 124.646 1.178 . . . . 0.0 112.535 -177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.433 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 34.1 t70 -55.8 -42.28 75.37 Favored 'General case' 0 C--O 1.246 0.882 0 C-N-CA 123.77 0.828 . . . . 0.0 111.002 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.545 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.4 m -77.89 -33.96 19.1 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 C-N-CA 120.043 -0.663 . . . . 0.0 109.666 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.655 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -61.01 -37.87 84.05 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.213 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 45.3 mt-10 -57.16 -46.14 83.03 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.797 175.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.08 -19.03 61.88 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 -179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.3 mp -88.58 -15.63 34.63 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.65 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.8 mt -46.22 -49.68 41.06 Favored Pre-proline 0 N--CA 1.483 1.21 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -64.96 -15.55 51.03 Favored 'Trans proline' 0 C--N 1.368 1.562 0 C-N-CA 121.808 1.672 . . . . 0.0 112.942 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -113.65 3.38 15.61 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.664 -175.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 49.1 tp -57.79 121.35 49.04 Favored Pre-proline 0 C--N 1.322 -0.618 0 O-C-N 123.689 0.618 . . . . 0.0 110.517 -178.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.41 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 37.2 Cg_exo -62.29 145.97 95.91 Favored 'Trans proline' 0 C--O 1.244 0.782 0 C-N-CA 122.733 2.289 . . . . 0.0 111.562 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.79 116.34 6.87 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 123.411 0.684 . . . . 0.0 111.839 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.86 -27.08 15.57 Favored Glycine 0 N--CA 1.439 -1.153 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -178.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.15 164.19 25.89 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-O 121.741 0.781 . . . . 0.0 110.848 179.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 25.4 m -143.75 165.99 26.13 Favored 'General case' 0 C--N 1.276 -2.625 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.655 HD13 ' HB3' ' A' ' 41' ' ' GLN . 43.7 mt -90.9 107.86 23.76 Favored Pre-proline 0 C--N 1.296 -1.731 0 O-C-N 123.521 0.513 . . . . 0.0 109.949 179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' O ' ' A' ' 53' ' ' SER . 12.9 Cg_exo -68.43 128.41 17.24 Favored 'Trans proline' 0 N--CA 1.452 -0.962 0 C-N-CA 122.3 2.0 . . . . 0.0 110.215 178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -75.81 -39.53 56.68 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -172.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 77.4 p -106.22 161.76 14.24 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.599 -0.84 . . . . 0.0 110.341 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.522 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.39 -38.16 68.51 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 124.016 0.822 . . . . 0.0 109.053 174.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -58.76 -49.0 79.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-N 114.957 -1.02 . . . . 0.0 111.738 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 39.8 mm-40 -67.03 -32.66 74.02 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.048 0.451 . . . . 0.0 110.941 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 57' ' ' THR . 82.1 mt -63.93 -43.07 97.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 176.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.522 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -71.47 -31.97 67.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.207 -179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.453 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 16.7 p30 -78.59 -38.61 39.63 Favored 'General case' 0 CA--C 1.508 -0.666 0 C-N-CA 120.609 -0.436 . . . . 0.0 112.161 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.4 m -80.82 -46.76 14.85 Favored 'General case' 0 N--CA 1.424 -1.747 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 ' C ' ' A' ' 69' ' ' GLN . 2.3 mm? -101.78 85.47 2.73 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.44 -175.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 18.0 p -109.85 -47.37 3.35 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-O 121.767 0.794 . . . . 0.0 110.669 178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.602 ' HB2' ' HD2' ' A' ' 68' ' ' PRO . 3.3 p -85.27 -167.06 0.13 Allowed Pre-proline 0 C--N 1.3 -1.565 0 C-N-CA 126.025 1.73 . . . . 0.0 110.149 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' A' ' 67' ' ' SER . 1.5 Cg_endo -45.33 -16.28 0.15 Allowed 'Trans proline' 0 C--N 1.408 3.659 0 C-N-CA 124.418 3.412 . . . . 0.0 113.395 171.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.543 ' NE2' HE22 ' A' ' 72' ' ' GLN . 9.9 mm100 -49.63 -36.09 23.35 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.805 0.842 . . . . 0.0 110.031 170.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.453 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 51.2 t80 -66.97 -30.9 71.15 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.705 -0.225 . . . . 0.0 110.912 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -68.2 -26.19 65.6 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-O 120.928 0.394 . . . . 0.0 110.238 177.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.543 HE22 ' NE2' ' A' ' 69' ' ' GLN . 11.4 mt-30 -70.96 -50.46 34.21 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.233 0.54 . . . . 0.0 109.855 177.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.11 -42.91 79.54 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.39 -177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 26.7 tp -73.88 -21.02 60.24 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.054 178.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.57 -43.09 45.5 Favored Glycine 0 N--CA 1.441 -0.986 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 176.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.494 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.3 ptt? -68.29 -32.3 72.35 Favored 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 47.4 t80 -59.9 -54.05 50.71 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.036 174.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.4 m -62.21 -36.68 82.69 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.605 -179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.56 -44.8 89.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.776 0.322 . . . . 0.0 110.809 178.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.49 -41.93 98.54 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 176.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.2 tt -60.22 -51.01 71.38 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 123.806 0.842 . . . . 0.0 109.697 178.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.41 -14.91 59.28 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.24 0.616 . . . . 0.0 112.236 -179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.3 m -97.94 -2.81 39.74 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 122.169 -0.332 . . . . 0.0 111.032 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 79.17 3.25 88.29 Favored Glycine 0 CA--C 1.524 0.598 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.162 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -68.07 -41.06 82.53 Favored 'General case' 0 C--O 1.214 -0.777 0 C-N-CA 124.147 0.979 . . . . 0.0 109.867 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.414 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.5 tp -101.58 8.95 41.64 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.707 -171.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -64.04 -69.53 1.3 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 114.11 -176.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -57.42 -25.03 63.99 Favored 'Trans proline' 0 C--N 1.357 1.011 0 C-N-CA 123.319 2.679 . . . . 0.0 113.269 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.687 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.44 -18.96 65.66 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.448 -0.796 . . . . 0.0 112.62 -176.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 23.9 mmt -75.65 -18.56 59.62 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -178.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 20.2 t -70.89 -28.77 64.79 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.474 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.687 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.7 pt20 -76.37 -6.99 54.06 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -175.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -100.44 -1.88 34.72 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.366 0.603 . . . . 0.0 109.638 178.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 75.79 30.68 57.46 Favored Glycine 0 N--CA 1.44 -1.061 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 -177.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 90' ' ' MET . 1.2 mp -73.65 141.73 79.78 Favored Pre-proline 0 N--CA 1.435 -1.201 0 CA-C-N 115.5 -0.35 . . . . 0.0 111.645 -178.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -41.93 152.1 0.16 Allowed 'Trans proline' 0 C--O 1.247 0.961 0 C-N-CA 124.915 3.743 . . . . 0.0 113.548 174.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.57 -40.15 82.33 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 123.642 0.777 . . . . 0.0 111.636 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -65.63 -37.57 86.94 Favored 'General case' 0 C--O 1.212 -0.882 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.65 -50.25 52.75 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.476 -177.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 11.1 p -65.32 -37.82 81.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.252 -179.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -69.31 -42.22 75.69 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.702 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.3 -37.0 83.85 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.488 0.185 . . . . 0.0 110.584 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.71 -37.56 86.77 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.934 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -72.32 -37.29 68.96 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.069 0.462 . . . . 0.0 111.112 176.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -74.26 -23.66 59.17 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.18 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 86.65 26.73 31.58 Favored Glycine 0 N--CA 1.44 -1.096 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -101.51 106.82 17.97 Favored 'General case' 0 C--N 1.311 -1.075 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 35.9 m -76.84 -30.54 18.47 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -175.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.41 -34.0 31.84 Favored 'General case' 0 C--O 1.248 1.017 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.694 -175.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.18 -43.62 81.72 Favored 'General case' 0 CA--C 1.501 -0.923 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 176.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.534 ' O ' ' HG3' ' A' ' 115' ' ' MET . 88.5 t80 -56.96 -52.85 63.59 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.865 178.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.35 -48.66 73.89 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.065 -179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -67.14 -41.98 85.19 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.155 -176.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.66 -33.19 75.33 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.09 -177.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 86.0 mtp -68.04 -55.01 14.12 Favored 'General case' 0 C--O 1.216 -0.709 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.314 178.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.281 0.6 OUTLIER -61.33 -26.29 67.71 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 -176.547 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -84.35 -57.0 3.34 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.19 0.519 . . . . 0.0 111.628 175.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -86.97 -11.24 51.12 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -167.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.82 5.8 20.42 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.151 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 27.1 tptp -101.16 95.08 4.42 Favored Pre-proline 0 C--N 1.31 -1.13 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 174.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.72 -21.71 16.25 Favored 'Trans proline' 0 C--O 1.241 0.655 0 C-N-CA 122.569 2.179 . . . . 0.0 114.189 -170.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 68.01 -87.57 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.648 1.179 . . . . 0.0 111.833 -177.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 125' ' ' GLU . 2.9 pt20 -149.77 170.86 17.75 Favored 'General case' 0 C--N 1.294 -1.833 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -74.7 -42.57 58.15 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.925 178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.535 ' HB2' ' NE2' ' A' ' 123' ' ' GLN . 75.4 mm-40 -67.07 127.4 32.45 Favored 'General case' 0 N--CA 1.425 -1.686 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 -175.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -86.82 77.43 1.99 Allowed Glycine 0 C--N 1.29 -2.002 0 N-CA-C 106.724 -2.55 . . . . 0.0 106.724 169.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -64.12 -36.16 83.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 122.973 0.509 . . . . 0.0 111.336 -172.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 19.7 m -66.1 130.68 44.09 Favored 'General case' 0 N--CA 1.434 -1.242 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -82.48 88.95 6.6 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 113.545 0.942 . . . . 0.0 113.545 -171.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -111.75 95.45 5.5 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.554 ' O ' ' HG2' ' A' ' 132' ' ' LYS . 54.4 tttm -113.8 -16.48 12.25 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 114.383 -1.281 . . . . 0.0 110.969 -175.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 131' ' ' LYS . 5.2 ptpp? 89.31 9.62 0.09 Allowed 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 128.05 2.54 . . . . 0.0 108.199 -171.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -129.77 110.84 12.07 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-N 113.897 -1.501 . . . . 0.0 108.451 -179.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.44 84.77 4.58 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 122.257 1.027 . . . . 0.0 108.643 174.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -88.25 86.32 7.06 Favored 'General case' 0 N--CA 1.414 -2.231 0 CA-C-N 114.988 -1.005 . . . . 0.0 109.449 -175.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -84.04 171.95 12.45 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-N 113.462 -1.699 . . . . 0.0 109.135 -177.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -86.81 96.88 10.35 Favored 'General case' 0 CA--C 1.484 -1.583 0 C-N-CA 118.998 -1.081 . . . . 0.0 108.563 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 24.4 ttt -115.6 79.18 1.26 Allowed 'General case' 0 C--N 1.28 -2.455 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 174.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 1.7 p -80.07 -55.73 4.74 Favored 'General case' 0 N--CA 1.426 -1.655 0 CA-C-N 113.972 -1.467 . . . . 0.0 112.085 -173.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -158.2 88.96 0.97 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.422 0.63 . . . . 0.0 110.932 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 19.1 t70 . . . . . 0 C--N 1.299 -1.624 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 175.918 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.9 p . . . . . 0 N--CA 1.45 -0.468 0 CA-C-O 120.889 0.376 . . . . 0.0 110.821 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -83.36 -23.45 32.46 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 122.992 0.517 . . . . 0.0 109.788 -178.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.38 -69.23 0.19 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.793 1.637 . . . . 0.0 112.655 176.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -87.94 156.6 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.055 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.705 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mp -99.04 -10.49 22.55 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 74.03 -45.92 0.61 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.834 1.654 . . . . 0.0 109.998 -174.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 m 60.68 24.54 14.34 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-O 122.683 1.23 . . . . 0.0 109.804 176.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 10.2 tpt -119.63 1.42 11.11 Favored 'General case' 0 N--CA 1.435 -1.18 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.468 -175.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 p30 52.51 26.33 4.19 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 126.04 1.736 . . . . 0.0 113.843 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.8 t -128.55 119.67 20.49 Favored Pre-proline 0 C--N 1.311 -1.106 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -65.96 -33.55 41.76 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.945 1.764 . . . . 0.0 111.96 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 71.15 152.92 0.12 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 125.285 1.434 . . . . 0.0 113.059 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -122.98 89.57 0.42 Allowed Glycine 0 N--CA 1.435 -1.403 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 178.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.06 -41.65 65.83 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.196 2.598 . . . . 0.0 112.428 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 58.56 -166.26 0.16 Allowed 'General case' 0 C--O 1.252 1.202 0 C-N-CA 124.265 1.026 . . . . 0.0 112.657 178.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -170.42 64.67 0.16 Allowed Glycine 0 N--CA 1.438 -1.205 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 177.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.09 -174.08 47.19 Favored Glycine 0 N--CA 1.44 -1.086 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 -173.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -91.56 73.32 5.95 Favored 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 118.407 1.104 . . . . 0.0 112.069 178.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -83.37 171.19 13.75 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 106.525 -1.657 . . . . 0.0 106.525 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.9 t -59.46 114.9 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 175.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.553 ' O ' HG12 ' A' ' 25' ' ' VAL . 6.5 t70 -77.27 129.96 36.58 Favored 'General case' 0 CA--C 1.495 -1.143 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.453 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.6 pp -53.9 -43.75 69.96 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -176.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.453 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -84.37 -25.97 28.74 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.463 0.649 . . . . 0.0 110.614 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 t -72.19 -25.3 61.62 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.05 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.553 HG12 ' O ' ' A' ' 21' ' ' ASP . 11.4 p -103.99 -47.89 10.09 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.146 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.676 -178.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' HG13 ' A' ' 25' ' ' VAL . 94.7 mt -104.68 104.57 14.4 Favored 'General case' 0 N--CA 1.436 -1.133 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 11.4 p -88.32 162.15 40.83 Favored Pre-proline 0 C--N 1.294 -1.825 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.455 -178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_exo -52.83 -33.85 62.82 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 123.298 2.666 . . . . 0.0 112.953 -178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -66.39 -32.69 74.24 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 123.142 0.577 . . . . 0.0 111.811 -178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.8 mt -82.49 -33.63 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.912 0.863 . . . . 0.0 109.13 -179.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.501 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 28.5 mmt -79.72 -12.65 59.79 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.789 -178.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -56.31 -56.89 26.67 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.827 1.047 . . . . 0.0 113.827 -176.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.75 -24.26 47.51 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 121.42 1.413 . . . . 0.0 112.622 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.1 mt -78.4 -54.03 12.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.785 -176.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.436 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -72.52 -11.88 60.85 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -177.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.43 -11.15 60.37 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.272 0.558 . . . . 0.0 110.771 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.565 ' O ' HG22 ' A' ' 40' ' ' VAL . 40.7 t-20 -92.07 122.01 34.17 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.23 -21.71 66.31 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 112.972 0.731 . . . . 0.0 112.972 -174.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.78 -31.18 59.38 Favored 'General case' 0 C--O 1.246 0.921 0 C-N-CA 120.384 -0.527 . . . . 0.0 110.381 -176.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.3 m -74.71 -35.79 38.27 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.495 ' HB3' HD13 ' A' ' 54' ' ' LEU . 78.3 mt-30 -59.88 -36.97 78.06 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.85 177.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -62.46 -39.05 92.16 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.361 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 9.8 mpt_? -75.06 -21.95 58.68 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 178.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.9 mp -85.34 -17.06 37.92 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.769 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 54.2 mt -46.36 -48.65 45.58 Favored Pre-proline 0 N--CA 1.484 1.262 0 N-CA-C 115.251 1.575 . . . . 0.0 115.251 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -64.0 -19.93 67.13 Favored 'Trans proline' 0 C--N 1.371 1.731 0 C-N-CA 121.875 1.717 . . . . 0.0 112.59 -179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -111.81 3.01 17.38 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.92 -174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.55 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 64.7 tp -58.36 115.4 11.35 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.126 0.891 . . . . 0.0 110.601 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -65.96 134.84 38.65 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 122.33 2.02 . . . . 0.0 110.027 177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 50.7 m -65.01 129.97 41.66 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.464 -179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.66 -29.46 9.89 Favored Glycine 0 N--CA 1.439 -1.104 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -87.43 163.13 16.9 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 121.178 0.513 . . . . 0.0 111.508 178.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 41.1 m -130.58 169.8 15.12 Favored 'General case' 0 C--N 1.29 -1.987 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.742 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.495 HD13 ' HB3' ' A' ' 41' ' ' GLN . 56.0 mt -99.25 105.46 32.8 Favored Pre-proline 0 C--N 1.292 -1.907 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HB2' HG12 ' A' ' 61' ' ' ILE . 4.2 Cg_exo -72.8 135.09 22.98 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.815 1.677 . . . . 0.0 111.003 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -87.16 -44.62 11.36 Favored 'General case' 0 C--N 1.311 -1.086 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.497 ' O ' HG13 ' A' ' 61' ' ' ILE . 44.4 p -97.65 152.61 18.9 Favored 'General case' 0 C--N 1.306 -1.298 0 O-C-N 122.018 -0.426 . . . . 0.0 111.692 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.407 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -56.17 -41.03 74.85 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.018 0.527 . . . . 0.0 111.514 -179.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -69.94 -40.47 75.47 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.8 pt-20 -68.4 -29.2 67.83 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.009 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 57' ' ' THR . 78.1 mt -58.1 -41.94 81.84 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.731 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 174.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -69.78 -25.52 63.84 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 121.586 0.708 . . . . 0.0 110.131 -178.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -82.45 -60.8 2.07 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.368 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.7 m -61.33 -41.73 97.51 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 123.638 0.775 . . . . 0.0 110.96 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.4 mt -106.72 90.95 3.48 Favored 'General case' 0 N--CA 1.431 -1.376 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 -178.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 m -92.64 -62.44 1.39 Allowed 'General case' 0 C--N 1.306 -1.322 0 CA-C-O 121.245 0.545 . . . . 0.0 110.155 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.575 ' OG ' ' HD3' ' A' ' 68' ' ' PRO . 1.9 p -146.87 -62.57 0.02 OUTLIER Pre-proline 0 CA--C 1.555 1.153 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -179.05 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.575 ' HD3' ' OG ' ' A' ' 67' ' ' SER . 24.1 Cg_exo -66.87 -43.1 7.41 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.592 1.528 . . . . 0.0 110.517 179.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.2 mp0 -70.61 -32.24 69.52 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.09 -43.67 91.35 Favored 'General case' 0 N--CA 1.435 -1.199 0 CA-C-N 115.003 -0.998 . . . . 0.0 110.989 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -65.3 -29.97 70.78 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.472 -0.491 . . . . 0.0 111.227 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -69.13 -47.88 63.9 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-O 121.358 0.599 . . . . 0.0 110.389 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.84 -37.22 76.09 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.003 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 18.1 tp -73.78 -22.37 59.86 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -40.13 82.99 Favored Glycine 0 N--CA 1.44 -1.034 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 174.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.55 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.8 ptt? -72.1 -33.23 67.7 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.408 -0.517 . . . . 0.0 109.747 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -60.77 -53.23 59.85 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.266 175.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.9 m -60.59 -36.16 77.87 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.465 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.97 -46.26 82.24 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.669 0.271 . . . . 0.0 110.85 178.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.24 -31.87 71.67 Favored 'General case' 0 C--O 1.249 1.039 0 CA-C-O 121.026 0.441 . . . . 0.0 110.503 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.402 HD22 HG12 ' A' ' 108' ' ' VAL . 5.7 tt -69.62 -52.39 26.36 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.99 -29.3 70.17 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.365 0.602 . . . . 0.0 111.313 -179.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 47.6 t -70.15 -33.99 72.47 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.301 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 98.96 3.2 57.0 Favored Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 111.136 -0.786 . . . . 0.0 111.136 -177.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.11 -28.21 54.36 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.981 0.42 . . . . 0.0 110.937 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.443 HD11 ' HB ' ' A' ' 40' ' ' VAL . 25.3 tp -98.3 6.31 47.48 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.792 -176.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.82 -64.95 3.42 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 115.757 -0.656 . . . . 0.0 114.158 -177.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_endo -53.36 -28.45 43.65 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 123.672 2.915 . . . . 0.0 113.394 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -60.92 -34.43 74.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 123.612 0.765 . . . . 0.0 112.586 -177.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.2 -22.71 62.91 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.235 0.54 . . . . 0.0 111.898 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 43.5 t -71.02 -26.94 63.33 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.579 -179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -72.61 -23.36 60.93 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.146 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.543 ' HB2' HD13 ' A' ' 95' ' ' LEU . 64.4 m-85 -91.75 -1.71 57.27 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 120.836 0.35 . . . . 0.0 110.973 -177.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.34 63.87 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.316 -178.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -79.15 152.67 76.73 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 115.387 -0.406 . . . . 0.0 111.536 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -45.21 139.13 9.09 Favored 'Trans proline' 0 C--O 1.249 1.029 0 C-N-CA 124.245 3.297 . . . . 0.0 112.405 177.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.28 -32.97 68.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -60.0 -45.77 91.66 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 123.925 0.89 . . . . 0.0 110.283 177.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.04 -49.3 20.23 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.66 -175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 6.7 p -62.71 -33.26 58.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 CA-C-O 121.01 0.433 . . . . 0.0 111.28 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -63.82 -48.66 75.92 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.22 -34.24 74.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.385 178.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.21 -29.82 69.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.259 0.552 . . . . 0.0 110.63 177.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -79.31 -39.58 32.5 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.52 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -69.83 -23.6 63.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.176 0.512 . . . . 0.0 110.376 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.92 36.06 11.93 Favored Glycine 0 N--CA 1.429 -1.799 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -112.71 109.32 18.75 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.402 HG12 HD22 ' A' ' 81' ' ' LEU . 27.9 m -76.79 -32.51 20.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -173.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.36 -37.54 57.1 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 120.107 -0.637 . . . . 0.0 110.833 -176.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.18 -41.61 97.04 Favored 'General case' 0 C--O 1.241 0.634 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 175.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.428 ' O ' ' HG2' ' A' ' 115' ' ' MET . 88.8 t80 -59.21 -55.11 39.1 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.638 177.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -56.63 -44.31 81.1 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.663 -178.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -58.62 -54.56 45.66 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.66 177.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.09 -33.13 75.09 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.537 -177.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 93.5 mmm -60.1 -57.31 13.39 Favored 'General case' 0 CA--C 1.503 -0.836 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.303 178.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.403 ' HG2' HG23 ' A' ' 25' ' ' VAL . 5.2 pp0? -81.24 -5.91 58.28 Favored 'General case' 0 C--O 1.214 -0.81 0 C-N-CA 119.823 -0.751 . . . . 0.0 112.911 -176.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 75.8 m-20 -83.26 -39.08 21.33 Favored 'General case' 0 N--CA 1.432 -1.349 0 C-N-CA 119.907 -0.717 . . . . 0.0 110.939 171.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -80.87 -58.62 3.01 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 120.952 0.406 . . . . 0.0 110.595 178.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -90.5 45.25 1.25 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -179.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -65.04 115.91 25.32 Favored Pre-proline 0 C--N 1.316 -0.881 0 CA-C-N 114.737 -1.119 . . . . 0.0 111.181 -175.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -75.76 69.76 6.01 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.792 2.328 . . . . 0.0 110.47 178.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -146.22 -50.22 0.22 Allowed 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 106.282 -1.747 . . . . 0.0 106.282 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.1 pt20 -108.44 -172.85 2.14 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-N 114.041 -1.436 . . . . 0.0 107.492 177.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.536 ' HG3' ' OE2' ' A' ' 125' ' ' GLU . 7.3 ttmm -127.8 156.8 41.92 Favored 'General case' 0 C--N 1.291 -1.955 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 174.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.536 ' OE2' ' HG3' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -76.31 71.41 3.0 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-O 122.505 1.145 . . . . 0.0 111.324 178.658 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -149.84 17.46 1.09 Allowed Glycine 0 N--CA 1.439 -1.146 0 CA-C-N 112.884 -1.962 . . . . 0.0 108.419 175.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -137.54 110.48 7.7 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 179.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 4.4 m -73.07 -28.95 62.6 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 123.71 0.632 . . . . 0.0 110.481 -175.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt 62.37 32.89 16.71 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-O 122.42 1.105 . . . . 0.0 108.329 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 12.9 p-10 -93.03 134.96 34.64 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.419 -1.264 . . . . 0.0 109.086 -177.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -176.87 -47.55 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -176.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -139.83 93.79 2.69 Favored 'General case' 0 N--CA 1.435 -1.212 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.357 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -79.79 -53.02 7.19 Favored 'General case' 0 CA--C 1.498 -1.023 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.376 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 68.76 177.08 0.26 Allowed 'General case' 0 C--O 1.246 0.891 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.991 -175.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -92.19 88.11 6.36 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.721 -175.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 71.42 -53.36 0.68 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.858 1.663 . . . . 0.0 111.705 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.7 t70 64.76 76.62 0.34 Allowed 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 125.891 1.676 . . . . 0.0 111.11 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.43 -176.66 4.81 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 114.783 -1.098 . . . . 0.0 111.063 -175.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 79.7 p 68.68 -42.46 0.48 Allowed 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 127.254 2.222 . . . . 0.0 114.044 177.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.8 pp -73.53 -25.64 60.5 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.172 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 16.0 t70 . . . . . 0 CA--C 1.499 -1.0 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.09 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 120.109 0.004 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -63.27 -79.89 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 120.745 0.307 . . . . 0.0 111.046 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -107.97 -4.07 18.22 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.241 0.543 . . . . 0.0 110.013 176.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mp -99.99 101.28 11.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 94.0 mt -113.27 85.1 2.12 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 174.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -159.8 34.22 0.18 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.682 -173.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.49 ' HA ' ' HA2' ' A' ' 51' ' ' GLY . 7.2 t -77.44 -45.47 25.66 Favored 'General case' 0 N--CA 1.435 -1.192 0 C-N-CA 119.545 -0.862 . . . . 0.0 108.842 178.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 83.5 mtp 45.46 -85.77 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 125.872 1.669 . . . . 0.0 114.879 177.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.502 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 60.4 t30 -99.76 120.22 39.38 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 47.5 t -110.19 95.03 19.9 Favored Pre-proline 0 C--N 1.307 -1.27 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 5.5 Cg_exo -81.7 -26.07 3.31 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.325 2.016 . . . . 0.0 111.148 177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 63.37 -165.43 0.24 Allowed 'General case' 0 C--O 1.253 1.238 0 C-N-CA 124.225 1.01 . . . . 0.0 111.192 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -174.49 111.53 0.37 Allowed Glycine 0 N--CA 1.433 -1.56 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.48 -54.24 1.83 Allowed 'Trans proline' 0 C--O 1.246 0.918 0 C-N-CA 122.703 2.269 . . . . 0.0 111.415 178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' HB1' HD21 ' A' ' 22' ' ' LEU . . . 66.15 -59.99 0.31 Allowed 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.719 1.608 . . . . 0.0 112.227 -178.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -89.99 -164.01 39.61 Favored Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 110.006 -1.238 . . . . 0.0 110.006 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 93.78 113.93 2.4 Favored Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 119.919 -1.134 . . . . 0.0 111.975 -178.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 71.98 -74.87 0.08 Allowed 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 125.208 1.403 . . . . 0.0 111.844 176.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -88.38 94.07 9.73 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.807 -0.179 . . . . 0.0 110.958 -176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.2 t 49.08 87.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.664 0 C-N-CA 125.695 1.598 . . . . 0.0 112.12 179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -70.09 101.48 1.84 Allowed 'General case' 0 CA--C 1.5 -0.965 0 C-N-CA 119.591 -0.843 . . . . 0.0 109.856 177.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.42 HD21 ' HB1' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -53.75 -30.47 44.51 Favored 'General case' 0 C--O 1.2 -1.519 0 N-CA-C 115.171 1.545 . . . . 0.0 115.171 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -83.98 -20.24 33.19 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 121.01 0.433 . . . . 0.0 111.644 -175.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.7 t -85.92 -30.83 22.52 Favored 'General case' 0 C--N 1.304 -1.373 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.019 176.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.2 p -87.53 -37.86 11.36 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.846 179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.41 100.08 7.43 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.6 p -83.44 162.83 52.38 Favored Pre-proline 0 C--N 1.297 -1.703 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.653 -177.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -52.55 -29.64 41.43 Favored 'Trans proline' 0 C--N 1.373 1.82 0 C-N-CA 123.213 2.608 . . . . 0.0 113.311 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.98 -33.89 76.55 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.146 0.498 . . . . 0.0 111.231 178.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -83.07 -40.66 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.145 -175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.505 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 26.4 mmt -78.1 -22.22 49.26 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -45.68 -58.54 5.92 Favored Pre-proline 0 CA--C 1.553 1.092 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -71.36 -19.68 28.64 Favored 'Trans proline' 0 C--N 1.367 1.524 0 CA-C-N 120.711 1.29 . . . . 0.0 112.931 -176.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.518 HG23 ' CE2' ' A' ' 93' ' ' PHE . 72.5 mt -82.79 -55.38 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.0 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.437 ' HB3' HD13 ' A' ' 61' ' ' ILE . 12.9 tp -62.93 -23.66 67.49 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 125.208 1.403 . . . . 0.0 111.408 -175.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.41 -18.78 61.69 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.891 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.492 ' O ' HG22 ' A' ' 40' ' ' VAL . 50.8 t-20 -75.92 125.15 28.56 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.257 0.551 . . . . 0.0 110.302 -177.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -57.93 -33.33 68.68 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.595 -0.73 . . . . 0.0 112.143 -178.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -64.97 -39.99 94.31 Favored 'General case' 0 C--O 1.266 1.952 0 C-N-CA 123.55 0.74 . . . . 0.0 110.653 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.3 m -75.33 -36.04 35.04 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.502 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.41 178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.512 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.2 mt-30 -61.17 -34.12 74.53 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.601 179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 48.2 mt-10 -61.7 -38.26 87.18 Favored 'General case' 0 N--CA 1.437 -1.119 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.567 176.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -71.72 -28.48 63.72 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 120.263 -0.575 . . . . 0.0 112.534 175.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.465 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.2 mp -83.01 -19.33 37.18 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 42' ' ' GLU . 34.5 mt -43.6 -50.72 17.12 Favored Pre-proline 0 N--CA 1.479 1.003 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -62.2 -18.54 62.79 Favored 'Trans proline' 0 C--N 1.365 1.418 0 C-N-CA 121.533 1.489 . . . . 0.0 113.059 -178.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.496 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 35.9 m-85 -113.08 9.86 18.65 Favored 'General case' 0 C--N 1.313 -1.015 0 O-C-N 122.07 -0.394 . . . . 0.0 110.352 -175.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tt -54.23 123.36 41.57 Favored Pre-proline 0 C--O 1.249 1.068 0 C-N-CA 123.584 0.754 . . . . 0.0 111.111 -177.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.538 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 42.6 Cg_exo -59.59 138.0 80.92 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 123.874 3.049 . . . . 0.0 112.985 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 13.6 m -78.72 125.29 29.17 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.056 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.49 ' HA2' ' HA ' ' A' ' 7' ' ' THR . . . 108.11 -33.81 6.03 Favored Glycine 0 N--CA 1.439 -1.11 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 -178.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -91.12 -175.38 4.28 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 114.885 -0.658 . . . . 0.0 110.014 177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.2 m -150.85 178.74 8.85 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.688 -1.227 . . . . 0.0 107.688 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.512 HD13 ' HB3' ' A' ' 41' ' ' GLN . 91.2 mt -85.64 112.39 44.23 Favored Pre-proline 0 C--N 1.31 -1.15 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.408 ' HB2' HG12 ' A' ' 61' ' ' ILE . 5.5 Cg_exo -73.46 128.99 13.27 Favored 'Trans proline' 0 N--CA 1.441 -1.563 0 C-N-CA 121.15 1.233 . . . . 0.0 109.552 176.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -85.8 -53.92 4.83 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.42 -172.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.503 ' O ' ' HG2' ' A' ' 60' ' ' GLU . 61.3 p -85.21 146.31 27.15 Favored 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 120.459 -0.497 . . . . 0.0 110.683 -179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 61' ' ' ILE . . . -57.39 -34.52 68.94 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 121.332 0.587 . . . . 0.0 110.446 179.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -60.73 -50.23 74.29 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.666 176.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.6 pt-20 -71.12 -24.47 62.29 Favored 'General case' 0 C--O 1.214 -0.778 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.133 -178.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.438 HG23 HD12 ' A' ' 65' ' ' LEU . 61.0 mt -59.54 -43.74 91.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.5 mm-40 -67.19 -47.4 71.01 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -66.99 -47.12 72.49 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.625 -1.17 . . . . 0.0 113.808 -174.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 56.0 m -80.28 -40.45 26.86 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.513 ' HB3' ' HA ' ' A' ' 70' ' ' PHE . 78.5 mt -86.35 -54.65 4.31 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.162 -173.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 21.9 m 54.96 -79.61 0.01 OUTLIER 'General case' 0 CA--C 1.562 1.43 0 C-N-CA 124.907 1.283 . . . . 0.0 113.847 178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.404 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 26.3 m -135.65 -68.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.446 0 CA-C-O 118.584 -0.722 . . . . 0.0 112.464 -179.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.404 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 36.4 Cg_endo -65.54 -49.17 2.58 Favored 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 121.486 1.457 . . . . 0.0 112.499 -175.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -71.5 -22.03 61.84 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.82 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.513 ' HA ' ' HB3' ' A' ' 65' ' ' LEU . 78.4 t80 -71.65 -47.83 51.75 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.808 178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -56.39 -41.81 76.88 Favored 'General case' 0 C--O 1.217 -0.629 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -63.93 -47.03 82.14 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-N 114.7 -1.137 . . . . 0.0 110.147 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -69.87 -31.37 69.17 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 121.672 0.748 . . . . 0.0 111.079 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.408 ' O ' ' HB3' ' A' ' 77' ' ' PHE . 21.4 tp -74.91 -20.42 59.71 Favored 'General case' 0 C--N 1.296 -1.753 0 CA-C-O 121.522 0.677 . . . . 0.0 109.268 177.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.23 -43.25 93.39 Favored Glycine 0 N--CA 1.448 -0.555 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.521 174.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.538 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 25.3 ptt? -66.9 -32.17 73.25 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.215 0.531 . . . . 0.0 110.072 177.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 52.6 t80 -63.05 -48.58 78.09 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.861 176.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 47.6 t -57.71 -42.05 82.97 Favored 'General case' 0 C--O 1.237 0.441 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.826 178.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.4 -44.96 95.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.41 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.86 -32.12 69.02 Favored 'General case' 0 C--O 1.248 1.004 0 CA-C-O 121.05 0.452 . . . . 0.0 110.941 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HA ' ' HB3' ' A' ' 86' ' ' LEU . 5.0 tt -66.6 -54.04 27.77 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.626 -0.716 . . . . 0.0 109.294 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.95 71.06 Favored 'General case' 0 C--O 1.244 0.8 0 CA-C-O 121.257 0.551 . . . . 0.0 111.465 -178.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 46.9 t -64.91 -26.94 68.53 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.035 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.44 -10.41 71.15 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.223 -0.751 . . . . 0.0 111.223 -178.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -74.58 -16.64 60.8 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -176.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' A' ' 81' ' ' LEU . 33.1 tp -103.95 4.19 34.39 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.69 0.757 . . . . 0.0 108.995 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.518 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.23 -65.8 2.62 Favored Glycine 0 N--CA 1.443 -0.865 0 CA-C-N 115.117 -0.947 . . . . 0.0 114.176 -177.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -57.55 -24.32 61.2 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.172 2.581 . . . . 0.0 112.203 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.676 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.4 mp -67.54 -19.82 65.33 Favored 'General case' 0 C--O 1.207 -1.156 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.107 -179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.5 mmt -76.8 -18.89 58.14 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.433 0.635 . . . . 0.0 111.388 179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 37.8 t -74.12 -23.61 59.33 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.975 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.676 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.6 pt20 -82.81 1.09 40.77 Favored 'General case' 0 C--O 1.219 -0.55 0 O-C-N 122.057 -0.402 . . . . 0.0 111.314 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.544 ' HB2' HD13 ' A' ' 95' ' ' LEU . 43.8 m-85 -111.55 1.73 17.02 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.596 0.236 . . . . 0.0 110.583 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 65.53 34.99 90.67 Favored Glycine 0 N--CA 1.45 -0.407 0 N-CA-C 111.709 -0.557 . . . . 0.0 111.709 -177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.544 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.7 mp -72.05 148.27 91.55 Favored Pre-proline 0 C--N 1.318 -0.791 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -43.16 145.95 1.16 Allowed 'Trans proline' 0 C--N 1.359 1.129 0 C-N-CA 124.27 3.313 . . . . 0.0 112.845 175.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -57.99 -41.35 82.84 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.667 -0.697 . . . . 0.0 112.415 -176.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.42 -37.75 83.54 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.42 0.629 . . . . 0.0 110.163 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.02 -49.73 55.08 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.488 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -65.42 -35.11 74.53 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.684 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.07 -51.75 68.28 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 121.053 0.454 . . . . 0.0 110.275 175.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.0 -38.27 82.15 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.345 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.518 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -65.37 -45.14 85.3 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.772 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 28.0 m-80 -63.53 -35.74 81.47 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.362 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.21 -23.21 51.42 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.165 0.507 . . . . 0.0 110.585 178.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 83.92 36.15 14.07 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 121.061 -0.59 . . . . 0.0 111.724 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -110.48 109.23 19.51 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.45 -33.19 26.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -76.3 -34.56 59.06 Favored 'General case' 0 C--O 1.248 0.981 0 C-N-CA 120.524 -0.471 . . . . 0.0 111.506 -176.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.28 -44.67 75.0 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -57.99 -51.15 70.86 Favored 'General case' 0 CA--C 1.493 -1.231 0 O-C-N 123.888 0.743 . . . . 0.0 109.596 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -52.6 -49.13 65.66 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 124.159 0.912 . . . . 0.0 111.738 -179.061 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -67.52 -53.58 27.36 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.561 -177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.96 -30.87 71.89 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.225 -176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 11.4 tpt -67.63 -49.11 64.6 Favored 'General case' 0 N--CA 1.432 -1.348 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.432 ' HG2' HG23 ' A' ' 25' ' ' VAL . 1.2 pp0? -72.24 -30.95 65.37 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -176.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -87.03 -14.06 42.63 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 119.303 -0.959 . . . . 0.0 112.609 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -104.83 -57.64 2.0 Allowed 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 177.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.25 -25.55 63.42 Favored 'General case' 0 CA--C 1.503 -0.833 0 O-C-N 123.361 0.413 . . . . 0.0 111.549 -173.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 116' ' ' GLN . 52.3 tptt -104.11 99.33 16.48 Favored Pre-proline 0 N--CA 1.428 -1.535 0 N-CA-C 105.767 -1.938 . . . . 0.0 105.767 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.86 92.7 1.03 Allowed 'Trans proline' 0 N--CA 1.436 -1.906 0 C-N-CA 121.752 1.635 . . . . 0.0 113.35 -174.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -86.91 84.32 7.36 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 174.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.4 121.64 6.2 Favored 'General case' 0 N--CA 1.432 -1.339 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 -178.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 63.1 mttp -124.66 -66.89 0.94 Allowed 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.876 178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 65.54 -78.23 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 124.804 1.242 . . . . 0.0 109.633 -176.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.61 -96.43 0.29 Allowed Glycine 0 C--N 1.314 -0.693 0 N-CA-C 114.216 0.446 . . . . 0.0 114.216 175.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -89.65 113.89 25.43 Favored 'General case' 0 C--O 1.244 0.813 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . 0.504 HG22 ' HB2' ' A' ' 130' ' ' ASP . 5.7 m -82.23 -52.67 6.74 Favored 'General case' 0 N--CA 1.425 -1.687 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.708 -171.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm 58.84 29.02 18.24 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.164 0.586 . . . . 0.0 111.933 -178.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.504 ' HB2' HG22 ' A' ' 128' ' ' THR . 12.6 t70 -75.36 161.75 28.99 Favored 'General case' 0 C--O 1.252 1.197 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 -178.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? 76.92 -65.81 0.27 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.78 1.632 . . . . 0.0 111.107 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -146.14 149.18 33.51 Favored 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 -177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -86.62 56.99 4.25 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 59.7 -101.09 0.11 Allowed 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.466 1.507 . . . . 0.0 111.913 -173.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -162.6 162.87 27.35 Favored 'General case' 0 N--CA 1.435 -1.219 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -179.6 -39.7 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.094 0 O-C-N 124.58 1.175 . . . . 0.0 108.064 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.8 t70 66.66 78.26 0.26 Allowed 'General case' 0 CA--C 1.495 -1.147 0 N-CA-C 106.854 -1.535 . . . . 0.0 106.854 -170.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 59.8 mtt -80.75 75.97 7.66 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 114.103 -1.408 . . . . 0.0 110.781 -173.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.6 m -100.48 -46.22 5.29 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.66 -178.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.9 pp -98.86 -18.93 17.65 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.454 0.645 . . . . 0.0 111.242 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 C--N 1.307 -1.259 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 179.706 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 N--CA 1.437 -1.088 0 CA-C-O 120.908 0.385 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -99.53 83.04 2.73 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.016 0.436 . . . . 0.0 111.632 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.44 48.52 21.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.781 0.832 . . . . 0.0 110.203 -179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 51.2 mm -74.27 113.97 13.39 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.034 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.781 -176.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.72 106.12 12.48 Favored 'General case' 0 N--CA 1.431 -1.377 0 N-CA-C 106.728 -1.582 . . . . 0.0 106.728 176.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -115.11 19.22 15.84 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.42 0.629 . . . . 0.0 111.837 -176.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.8 m -121.96 97.29 5.42 Favored 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 175.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -83.55 112.18 19.76 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.792 0.806 . . . . 0.0 110.935 -179.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -128.1 127.61 43.37 Favored 'General case' 0 C--N 1.296 -1.76 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.4 m -83.11 148.98 57.85 Favored Pre-proline 0 C--N 1.294 -1.82 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -85.75 -171.52 0.91 Allowed 'Trans proline' 0 N--CA 1.444 -1.425 0 C-N-CA 122.438 2.092 . . . . 0.0 111.072 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.94 -175.02 4.88 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.975 -176.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -131.63 132.08 6.61 Favored Glycine 0 N--CA 1.414 -2.777 0 N-CA-C 108.048 -2.021 . . . . 0.0 108.048 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.54 123.85 14.83 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 123.019 2.48 . . . . 0.0 112.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 74.76 129.7 0.04 OUTLIER 'General case' 0 C--O 1.243 0.734 0 C-N-CA 126.086 1.754 . . . . 0.0 112.826 179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -83.17 63.44 4.48 Favored Glycine 0 C--N 1.316 -0.569 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 175.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 148.55 95.14 0.14 Allowed Glycine 0 N--CA 1.431 -1.666 0 N-CA-C 107.449 -2.261 . . . . 0.0 107.449 -175.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -98.65 109.49 22.24 Favored 'General case' 0 C--N 1.296 -1.718 0 CA-C-O 121.273 0.559 . . . . 0.0 111.112 -173.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -98.77 147.72 24.61 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.8 t 68.55 105.05 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.208 0 O-C-N 124.063 0.852 . . . . 0.0 109.261 -174.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.403 ' O ' HG12 ' A' ' 25' ' ' VAL . 19.6 t70 -70.71 108.97 4.66 Favored 'General case' 0 CA--C 1.494 -1.182 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.086 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD23 ' A' ' 74' ' ' LEU . 0.6 OUTLIER -51.15 -36.25 39.97 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.6 -24.36 49.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.934 0.397 . . . . 0.0 111.98 -175.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -83.05 -38.89 21.94 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.198 0.523 . . . . 0.0 110.728 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.428 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.6 p -82.56 -41.4 17.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.702 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 84.7 mt -112.29 91.45 3.66 Favored 'General case' 0 N--CA 1.435 -1.18 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 19.3 p -83.29 160.36 59.92 Favored Pre-proline 0 C--N 1.293 -1.857 0 CA-C-N 115.306 -0.861 . . . . 0.0 112.314 -173.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -52.97 -31.87 55.03 Favored 'Trans proline' 0 C--N 1.367 1.54 0 C-N-CA 123.448 2.765 . . . . 0.0 113.399 179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -66.5 -34.28 77.57 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.9 mt -77.13 -38.16 27.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.931 0.872 . . . . 0.0 108.897 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.488 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.7 mmt -80.88 -7.48 59.47 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.664 -1.153 . . . . 0.0 113.653 -175.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.27 -57.85 23.95 Favored Pre-proline 0 CA--C 1.553 1.066 0 N-CA-C 113.056 0.762 . . . . 0.0 113.056 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -70.36 -22.47 29.27 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 121.35 1.367 . . . . 0.0 112.292 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.5 mt -75.19 -52.88 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.106 -178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.488 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -73.86 -15.06 61.17 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.98 -3.32 31.63 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.446 0.641 . . . . 0.0 110.652 177.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 48.5 t30 -100.83 112.57 25.02 Favored 'General case' 0 N--CA 1.427 -1.589 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.59 -21.1 62.25 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 123.286 0.634 . . . . 0.0 112.307 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 39.1 t70 -58.64 -41.56 86.31 Favored 'General case' 0 C--O 1.266 1.947 0 CA-C-O 121.721 0.772 . . . . 0.0 110.382 177.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 9.1 m -76.39 -36.29 28.75 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.737 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.567 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.6 mt-30 -59.78 -38.24 81.33 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.06 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.5 -43.77 84.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.637 -1.165 . . . . 0.0 109.709 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.444 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 5.9 mpt_? -77.31 -21.31 53.67 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.485 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.6 mp -81.41 -20.1 41.16 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 177.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.408 HD21 HD11 ' A' ' 54' ' ' LEU . 49.8 mt -48.78 -47.89 71.56 Favored Pre-proline 0 CA--C 1.556 1.19 0 N-CA-C 115.859 1.8 . . . . 0.0 115.859 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -66.98 -11.92 34.1 Favored 'Trans proline' 0 C--N 1.369 1.607 0 C-N-CA 122.14 1.893 . . . . 0.0 112.958 178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -114.58 1.29 14.22 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.237 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.548 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.8 tt -64.91 119.67 60.16 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.906 -173.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 21.5 Cg_exo -62.89 157.64 47.21 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 123.543 2.829 . . . . 0.0 113.659 -177.245 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 116.18 7.73 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.758 -176.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 107.98 -20.9 30.48 Favored Glycine 0 N--CA 1.435 -1.369 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.185 179.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.466 ' OE2' ' HB2' ' A' ' 49' ' ' PRO . 0.4 OUTLIER -73.48 161.2 30.66 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.786 0.803 . . . . 0.0 112.03 -179.157 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.1 m -145.42 167.07 23.84 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.567 HD13 ' HB3' ' A' ' 41' ' ' GLN . 90.3 mt -96.91 110.99 56.3 Favored Pre-proline 0 C--N 1.299 -1.617 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -176.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.421 ' HB2' HG12 ' A' ' 61' ' ' ILE . 2.9 Cg_exo -73.33 131.41 16.37 Favored 'Trans proline' 0 N--CA 1.446 -1.323 0 C-N-CA 121.688 1.592 . . . . 0.0 109.526 173.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -86.17 -52.26 5.78 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 113.639 0.978 . . . . 0.0 113.639 -171.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.455 ' O ' HG13 ' A' ' 61' ' ' ILE . 61.5 p -94.15 154.78 17.4 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 120.403 -0.519 . . . . 0.0 111.289 -178.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -55.45 -37.46 67.76 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 123.215 0.606 . . . . 0.0 111.288 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -55.82 -56.61 18.47 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.776 0.83 . . . . 0.0 111.206 178.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' THR . 12.4 pt-20 -69.63 -27.14 64.81 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.731 -177.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 57' ' ' THR . 83.8 mt -62.82 -48.4 88.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 174.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 28.5 mm-40 -66.26 -38.21 87.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.049 0.452 . . . . 0.0 110.687 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -71.57 -35.78 70.7 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.439 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.0 m -90.96 -40.67 11.56 Favored 'General case' 0 C--N 1.313 -0.995 0 C-N-CA 120.521 -0.472 . . . . 0.0 111.356 -177.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 34.7 mt -110.72 91.59 3.72 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.7 t -115.59 -38.29 3.78 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 120.001 -0.68 . . . . 0.0 112.176 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.646 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.27 49.6 m -138.74 -87.12 0.0 OUTLIER Pre-proline 0 CA--C 1.584 2.285 0 N-CA-C 114.079 1.14 . . . . 0.0 114.079 179.593 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.646 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 28.5 Cg_exo -64.67 -42.8 14.68 Favored 'Trans proline' 0 C--N 1.4 3.274 0 CA-C-N 123.006 2.109 . . . . 0.0 111.229 -179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.4 mm-40 -60.47 -35.07 75.01 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.475 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.408 ' CE2' HD22 ' A' ' 74' ' ' LEU . 68.9 t80 -71.3 -41.09 70.37 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.496 -178.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -62.81 -29.24 70.57 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 121.152 0.501 . . . . 0.0 111.456 176.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -72.61 -49.43 32.15 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.636 176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.79 -39.49 87.81 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.218 179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 70' ' ' PHE . 27.1 tp -73.57 -20.76 60.54 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.6 -47.57 61.37 Favored Glycine 0 N--CA 1.437 -1.276 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 175.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.548 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -68.46 -29.94 68.7 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.188 0.518 . . . . 0.0 109.919 178.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -62.19 -53.61 52.79 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.07 175.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.0 m -65.03 -27.77 69.03 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.208 -179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.87 -50.58 64.01 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.025 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.08 -29.66 69.48 Favored 'General case' 0 C--O 1.253 1.24 0 CA-C-O 121.326 0.584 . . . . 0.0 110.563 178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.408 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -65.28 -48.75 72.07 Favored 'General case' 0 C--O 1.22 -0.498 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.93 -33.17 72.75 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 122.852 0.461 . . . . 0.0 110.748 179.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 45.5 m -71.52 -13.83 61.92 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.892 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 75.97 4.4 77.41 Favored Glycine 0 C--N 1.335 0.516 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 -179.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -83.85 -18.86 36.12 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.436 0.636 . . . . 0.0 110.295 -176.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.472 HD12 HD22 ' A' ' 89' ' ' LEU . 33.0 tp -101.45 6.44 42.46 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 114.844 -1.071 . . . . 0.0 108.623 179.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -67.34 -66.23 2.43 Favored Glycine 0 CA--C 1.521 0.416 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.908 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -56.65 -23.97 51.84 Favored 'Trans proline' 0 C--N 1.366 1.459 0 C-N-CA 123.192 2.595 . . . . 0.0 112.436 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.67 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.6 mp -66.89 -23.5 66.01 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.168 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.422 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 21.8 mmt -75.17 -20.21 59.45 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.408 0.623 . . . . 0.0 111.231 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.14 -31.61 66.14 Favored 'General case' 0 N--CA 1.439 -1.019 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.416 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.67 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 29.1 pt20 -75.79 -15.22 60.28 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-O 121.019 0.438 . . . . 0.0 111.227 -175.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 40.1 m-85 -93.04 -5.18 51.07 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.085 0.469 . . . . 0.0 110.008 178.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 72.25 34.85 60.78 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.6 mp -76.24 158.21 82.06 Favored Pre-proline 0 C--N 1.313 -0.983 0 C-N-CA 122.388 0.275 . . . . 0.0 110.929 179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -49.97 143.81 23.25 Favored 'Trans proline' 0 C--O 1.242 0.7 0 C-N-CA 123.358 2.706 . . . . 0.0 112.934 178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.434 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.68 -33.34 71.44 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.335 0.588 . . . . 0.0 110.645 178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -66.02 -39.59 90.36 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.378 176.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.66 -50.01 34.52 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.819 -177.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.434 HG12 ' HA ' ' A' ' 97' ' ' ALA . 8.9 p -62.5 -34.86 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.072 -179.482 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.572 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 15.8 tp10 -61.68 -53.34 57.38 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 176.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.65 -35.43 74.4 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.872 0.469 . . . . 0.0 111.625 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.59 71.47 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.045 0.45 . . . . 0.0 111.272 178.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -78.48 -33.15 48.43 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 120.99 0.424 . . . . 0.0 110.373 176.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.572 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 30.9 mmmt -74.99 -24.33 58.41 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.408 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 84.21 28.12 34.73 Favored Glycine 0 N--CA 1.434 -1.468 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.524 -179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -101.77 102.12 12.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 -178.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.89 -33.79 61.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.918 -175.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -66.77 -51.03 60.59 Favored 'General case' 0 C--O 1.246 0.886 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.274 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.29 -39.03 93.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.91 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 115' ' ' MET . 89.2 t80 -61.12 -48.83 79.84 Favored 'General case' 0 CA--C 1.52 -0.204 0 O-C-N 123.197 0.311 . . . . 0.0 110.489 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.43 -46.11 80.4 Favored 'General case' 0 C--O 1.24 0.556 0 O-C-N 123.631 0.582 . . . . 0.0 110.724 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -63.27 -51.81 64.62 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.959 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 118' ' ' ASN . . . -60.61 -32.63 71.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.252 -175.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 94.7 mmm -67.45 -50.47 59.1 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.368 177.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 25' ' ' VAL 0.259 0.8 OUTLIER -72.47 -32.05 65.92 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -176.615 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 40.9 p30 -82.24 -24.85 34.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 114' ' ' ALA . 12.4 m-80 -95.36 -54.03 3.55 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 113.182 0.808 . . . . 0.0 113.182 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -66.4 -76.01 0.08 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.097 -174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.8 pttm 36.57 77.95 0.37 Allowed Pre-proline 0 CA--C 1.558 1.252 0 C-N-CA 124.589 1.156 . . . . 0.0 112.079 178.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -51.78 -36.71 63.43 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.734 2.956 . . . . 0.0 114.67 -169.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.51 -29.86 68.55 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.95 56.33 1.95 Allowed 'General case' 0 N--CA 1.441 -0.881 0 CA-C-O 122.571 1.177 . . . . 0.0 109.335 -175.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -143.65 83.18 1.75 Allowed 'General case' 0 C--N 1.286 -2.174 0 N-CA-C 104.156 -2.535 . . . . 0.0 104.156 169.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -86.81 -23.94 25.18 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.102 -1.863 . . . . 0.0 112.483 -168.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -167.14 134.87 3.41 Favored Glycine 0 N--CA 1.432 -1.592 0 C-N-CA 119.641 -1.266 . . . . 0.0 112.702 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -96.7 -79.85 0.44 Allowed 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 174.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 23.6 m 57.91 -66.69 0.03 OUTLIER 'General case' 0 CA--C 1.565 1.557 0 C-N-CA 125.858 1.663 . . . . 0.0 114.013 177.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm 58.87 27.59 16.36 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.377 1.471 . . . . 0.0 112.266 179.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -154.86 107.26 2.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.123 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -103.47 -31.82 9.79 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.078 178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.4 ' HG3' ' H ' ' A' ' 133' ' ' ASP . 9.0 tptm 56.39 -171.22 0.08 Allowed 'General case' 0 CA--C 1.564 1.509 0 C-N-CA 125.032 1.333 . . . . 0.0 110.686 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.4 ' H ' ' HG3' ' A' ' 132' ' ' LYS . 17.4 t70 -159.0 -43.53 0.06 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 177.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 37.9 mm-40 77.57 125.13 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.716 1.206 . . . . 0.0 113.984 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -101.99 116.41 32.64 Favored 'General case' 0 N--CA 1.428 -1.556 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 -178.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -137.05 0.33 2.36 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 -176.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 62.9 t0 51.35 92.98 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 124.584 1.153 . . . . 0.0 110.692 -169.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 27.6 ttt -72.6 -15.79 61.74 Favored 'General case' 0 C--N 1.293 -1.891 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.811 -175.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 m -101.43 6.05 42.33 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.739 -178.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 5.6 tt -64.97 -52.61 55.29 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.195 -177.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.156 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 CA--C 1.542 0.656 0 N-CA-C 111.589 0.218 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.8 m120 69.63 159.8 0.19 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 175.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.66 88.66 2.15 Favored 'General case' 0 N--CA 1.425 -1.701 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 173.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.6 mt -78.05 92.71 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-O 121.79 0.805 . . . . 0.0 110.114 -173.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 tt 171.38 -32.63 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 103.113 -2.921 . . . . 0.0 103.113 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 73.4 -79.24 0.04 OUTLIER 'General case' 0 C--N 1.349 0.571 0 CA-C-N 113.364 -1.744 . . . . 0.0 111.336 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -150.13 125.0 9.85 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 -178.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 16.1 tpt -83.96 -39.9 19.16 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.579 ' O ' ' HD3' ' A' ' 11' ' ' PRO . 10.3 t30 69.35 159.25 0.18 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.915 175.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -97.25 92.19 1.16 Allowed Pre-proline 0 CA--C 1.55 0.948 0 CA-C-O 121.724 0.773 . . . . 0.0 109.168 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 9' ' ' ASN . 2.0 Cg_endo -82.65 -60.05 0.02 OUTLIER 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.273 1.982 . . . . 0.0 115.008 -173.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 66.65 26.31 9.71 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.969 0.908 . . . . 0.0 108.919 -170.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.88 125.27 8.18 Favored Glycine 0 N--CA 1.431 -1.635 0 CA-C-N 114.576 -1.193 . . . . 0.0 111.938 -176.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -102.65 19.81 0.19 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.875 2.384 . . . . 0.0 111.829 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.2 -175.82 0.2 Allowed 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.512 1.125 . . . . 0.0 110.616 -174.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -169.29 174.37 43.7 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.572 -1.011 . . . . 0.0 110.572 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 138.07 75.81 0.06 OUTLIER Glycine 0 C--N 1.306 -1.086 0 C-N-CA 120.703 -0.761 . . . . 0.0 111.366 179.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -88.21 146.46 25.35 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 71.84 -41.32 0.5 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.684 1.594 . . . . 0.0 113.754 173.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 t -93.49 127.59 45.46 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.344 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -86.77 96.82 10.31 Favored 'General case' 0 CA--C 1.492 -1.251 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 175.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 pp -62.13 -36.17 80.98 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 115.147 1.536 . . . . 0.0 115.147 -171.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' A' ' 71' ' ' GLN . . . -76.82 -23.59 52.77 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -174.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.1 p -85.24 -29.14 24.88 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 120.812 -0.355 . . . . 0.0 111.788 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 12.0 p -91.3 -33.27 5.62 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 CA-C-O 120.808 0.337 . . . . 0.0 111.676 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.6 mt -122.03 110.93 16.41 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.556 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 8.7 p -90.65 155.12 46.0 Favored Pre-proline 0 C--N 1.299 -1.603 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -176.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -49.85 -35.86 41.19 Favored 'Trans proline' 0 C--N 1.366 1.48 0 C-N-CA 124.185 3.257 . . . . 0.0 113.525 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.556 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 1.6 pm0 -63.42 -46.15 87.68 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 177.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 60.1 mt -66.27 -40.16 86.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.257 0.551 . . . . 0.0 110.102 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 80.0 mmm -86.15 -6.46 59.0 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.705 -173.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.72 -54.11 58.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -176.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.58 -14.49 39.7 Favored 'Trans proline' 0 C--N 1.374 1.876 0 C-N-CA 121.538 1.492 . . . . 0.0 112.576 -179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.4 mt -83.29 -55.77 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.4 mp -70.53 -17.62 62.94 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.68 -5.27 44.75 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.197 0.522 . . . . 0.0 111.428 178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.453 ' O ' HG22 ' A' ' 40' ' ' VAL . 26.0 t30 -92.77 123.76 36.28 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.73 178.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.456 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -56.48 -32.52 65.06 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 123.675 0.79 . . . . 0.0 111.982 -177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 41.8 t0 -60.37 -42.99 96.98 Favored 'General case' 0 C--O 1.249 1.027 0 C-N-CA 123.512 0.725 . . . . 0.0 111.221 -178.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.48 ' O ' HD13 ' A' ' 44' ' ' LEU . 8.1 m -74.0 -34.38 38.89 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.669 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.247 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.2 mt-30 -59.99 -38.0 81.29 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.507 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 42.7 mt-10 -59.35 -39.44 83.21 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.732 175.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -75.63 -28.23 58.74 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 178.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.48 HD13 ' O ' ' A' ' 40' ' ' VAL . 8.8 mp -81.59 -23.57 37.02 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -178.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 54' ' ' LEU . 41.3 mt -45.8 -48.46 39.46 Favored Pre-proline 0 N--CA 1.482 1.172 0 N-CA-C 115.848 1.796 . . . . 0.0 115.848 179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -64.34 -16.05 52.97 Favored 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 121.657 1.572 . . . . 0.0 113.049 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 61.8 m-85 -113.68 3.87 15.8 Favored 'General case' 0 C--N 1.31 -1.14 0 O-C-N 122.438 -0.164 . . . . 0.0 111.06 -175.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.521 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 9.6 tt -57.47 123.91 64.47 Favored Pre-proline 0 C--O 1.245 0.83 0 O-C-N 124.267 0.979 . . . . 0.0 112.215 -176.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 48' ' ' LEU . 10.6 Cg_exo -71.94 141.39 36.72 Favored 'Trans proline' 0 C--N 1.356 0.967 0 C-N-CA 122.885 2.39 . . . . 0.0 111.447 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 16.3 m -69.27 138.9 54.28 Favored 'General case' 0 C--N 1.3 -1.562 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.919 -177.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.86 -7.12 70.2 Favored Glycine 0 N--CA 1.437 -1.236 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.012 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -112.39 176.08 5.16 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.2 m -150.64 174.44 12.99 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.549 HD13 ' HB3' ' A' ' 41' ' ' GLN . 67.1 mt -92.26 112.45 55.24 Favored Pre-proline 0 C--N 1.309 -1.156 0 C-N-CA 122.612 0.365 . . . . 0.0 110.728 -177.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.04 127.56 15.35 Favored 'Trans proline' 0 N--CA 1.449 -1.093 0 C-N-CA 120.998 1.132 . . . . 0.0 109.283 174.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -80.26 -30.26 38.4 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -171.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 35.8 p -127.86 157.64 39.92 Favored 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.109 -0.636 . . . . 0.0 111.074 -177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -54.7 -40.62 69.37 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.196 0.999 . . . . 0.0 111.883 -177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -62.4 -47.82 82.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.725 178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -64.93 -29.58 70.52 Favored 'General case' 0 N--CA 1.448 -0.568 0 O-C-N 122.361 -0.212 . . . . 0.0 111.032 178.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.408 HG23 HD12 ' A' ' 65' ' ' LEU . 61.8 mt -59.54 -44.96 94.26 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.046 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.64 175.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -64.76 -30.97 72.0 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.091 0.472 . . . . 0.0 110.779 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -71.12 -60.83 2.02 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.019 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 m -73.93 -44.12 56.07 Favored 'General case' 0 N--CA 1.432 -1.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.75 -175.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.408 HD12 HG23 ' A' ' 61' ' ' ILE . 50.5 mt -101.68 84.64 2.6 Favored 'General case' 0 N--CA 1.428 -1.544 0 CA-C-O 121.913 0.863 . . . . 0.0 110.72 -174.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 14.2 p -85.49 -68.99 0.69 Allowed 'General case' 0 C--N 1.3 -1.549 0 CA-C-N 115.032 -0.986 . . . . 0.0 110.259 177.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.515 ' H ' ' HD2' ' A' ' 68' ' ' PRO . 69.7 m -146.5 -58.05 0.02 OUTLIER Pre-proline 0 C--N 1.306 -1.294 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.492 177.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD2' ' H ' ' A' ' 67' ' ' SER . 17.7 Cg_endo -61.51 -56.05 0.97 Allowed 'Trans proline' 0 C--N 1.379 2.141 0 CA-C-N 120.994 1.391 . . . . 0.0 111.514 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -64.71 -27.74 69.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.475 177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.437 ' CZ ' HD22 ' A' ' 74' ' ' LEU . 67.4 t80 -69.22 -41.14 77.42 Favored 'General case' 0 C--O 1.199 -1.598 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.376 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG2' ' HB2' ' A' ' 23' ' ' ALA . 55.8 mt-30 -63.46 -29.01 70.36 Favored 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 121.215 0.531 . . . . 0.0 110.976 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -75.43 -47.09 28.86 Favored 'General case' 0 C--N 1.303 -1.43 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.578 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.22 -39.35 75.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.276 0.56 . . . . 0.0 111.202 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' CZ ' ' A' ' 70' ' ' PHE . 40.3 tp -75.15 -20.97 59.11 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.04 -45.13 52.64 Favored Glycine 0 N--CA 1.431 -1.645 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.32 175.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.521 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 27.4 ptt? -67.57 -29.92 69.4 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 176.435 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.416 ' HB3' ' O ' ' A' ' 74' ' ' LEU . 46.3 t80 -62.98 -50.95 68.74 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.758 173.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 40.1 t -57.09 -41.02 78.12 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.916 0.886 . . . . 0.0 110.093 178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.71 -48.58 76.52 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.52 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.28 78.03 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 121.197 0.522 . . . . 0.0 110.77 179.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.416 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.9 tt -65.07 -50.11 67.43 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -59.57 -33.24 71.18 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 123.177 0.591 . . . . 0.0 111.831 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.9 m -76.02 -11.9 60.03 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.125 178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 81.37 2.77 90.64 Favored Glycine 0 C--N 1.332 0.328 0 CA-C-N 116.65 -0.25 . . . . 0.0 113.028 178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -80.08 -25.09 40.18 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-O 121.557 0.694 . . . . 0.0 110.836 -177.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.409 HD21 ' CE2' ' A' ' 77' ' ' PHE . 36.4 tp -98.66 4.4 47.92 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.787 -177.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -66.71 -65.48 2.79 Favored Glycine 0 C--N 1.318 -0.468 0 CA-C-N 115.095 -0.957 . . . . 0.0 114.206 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -57.02 -22.72 48.32 Favored 'Trans proline' 0 C--N 1.364 1.349 0 C-N-CA 123.146 2.564 . . . . 0.0 113.063 -178.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.641 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 9.3 mp -68.3 -24.29 64.84 Favored 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 112.621 0.601 . . . . 0.0 112.621 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.7 mmt -71.4 -20.65 62.1 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.178 0.513 . . . . 0.0 111.75 -178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 48.0 t -66.43 -35.97 81.63 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.129 -177.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.641 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 27.5 pt20 -75.41 -6.84 52.07 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 112.321 0.489 . . . . 0.0 112.321 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.549 ' HB2' HD13 ' A' ' 95' ' ' LEU . 56.6 m-85 -98.3 -9.25 25.75 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.116 0.484 . . . . 0.0 110.568 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 78.08 35.36 34.76 Favored Glycine 0 C--O 1.239 0.433 0 C-N-CA 120.623 -0.799 . . . . 0.0 111.631 -177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.549 HD13 ' HB2' ' A' ' 93' ' ' PHE . 3.4 mp -80.45 155.59 73.92 Favored Pre-proline 0 C--N 1.31 -1.112 0 C-N-CA 122.871 0.468 . . . . 0.0 111.048 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -46.85 140.46 12.99 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 123.881 3.054 . . . . 0.0 112.574 179.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.475 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -62.81 -30.3 71.37 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-O 121.212 0.529 . . . . 0.0 111.906 -177.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -77.43 -32.01 54.33 Favored 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.842 179.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.8 -45.72 57.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.998 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 97' ' ' ALA . 10.0 p -63.38 -35.66 73.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.032 177.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -61.06 -46.81 89.17 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.73 0.3 . . . . 0.0 110.411 174.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.28 -38.1 88.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.789 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.06 -34.53 78.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.117 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 23.8 m-80 -71.98 -42.0 67.03 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 176.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 29.5 mmmt -69.28 -24.3 63.95 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.26 178.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 87.42 26.75 29.5 Favored Glycine 0 N--CA 1.425 -2.063 0 C-N-CA 120.474 -0.87 . . . . 0.0 111.621 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -98.91 108.64 21.37 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 33.6 m -76.41 -28.99 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.245 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -175.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -77.75 -40.16 41.91 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.669 -0.813 . . . . 0.0 110.606 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.85 -39.14 93.09 Favored 'General case' 0 N--CA 1.445 -0.717 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.447 ' O ' ' HG2' ' A' ' 115' ' ' MET . 90.8 t80 -62.0 -55.49 28.71 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 176.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.05 -47.43 71.64 Favored 'General case' 0 C--O 1.238 0.477 0 O-C-N 123.75 0.656 . . . . 0.0 111.74 -178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 29.8 mtmt -63.48 -49.19 74.59 Favored 'General case' 0 CA--C 1.504 -0.794 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.489 179.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.17 -32.81 74.48 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.879 -175.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 92.0 mmm -60.92 -57.8 11.13 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 178.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . 0.259 0.7 OUTLIER -71.54 -16.9 62.34 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -176.356 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -78.5 -41.81 31.4 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.303 175.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 49.1 m-80 -79.99 -43.48 21.93 Favored 'General case' 0 CA--C 1.502 -0.892 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.921 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -81.99 66.84 7.75 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 122.211 1.005 . . . . 0.0 108.339 173.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -59.39 131.48 87.89 Favored Pre-proline 0 C--N 1.31 -1.12 0 CA-C-N 113.228 -1.805 . . . . 0.0 109.37 -177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -67.51 76.82 0.52 Allowed 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 122.645 2.23 . . . . 0.0 112.714 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 179.23 -39.57 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.304 0 C-N-CA 127.197 2.199 . . . . 0.0 106.189 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 50.0 86.1 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.166 1.787 . . . . 0.0 112.674 176.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -151.63 119.78 6.3 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.451 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -103.03 136.39 42.94 Favored 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 120.176 -0.61 . . . . 0.0 110.361 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 106.88 77.75 1.09 Allowed Glycine 0 N--CA 1.432 -1.585 0 CA-C-N 115.402 -0.817 . . . . 0.0 112.112 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -100.75 111.51 23.74 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 177.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 13.2 t -91.9 144.38 25.54 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.061 0.458 . . . . 0.0 110.987 -174.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -79.18 105.44 10.51 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.306 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.419 ' OD2' ' HB2' ' A' ' 132' ' ' LYS . 34.1 t70 -111.05 124.74 52.78 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.781 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.567 ' HD2' ' N ' ' A' ' 132' ' ' LYS . 0.0 OUTLIER -76.92 -35.35 57.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.772 0.32 . . . . 0.0 111.656 -179.484 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . 0.567 ' N ' ' HD2' ' A' ' 131' ' ' LYS . 17.2 ttmm 59.43 -83.68 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.289 1.435 . . . . 0.0 114.239 175.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . 0.423 ' CG ' ' H ' ' A' ' 134' ' ' GLU . 6.7 p-10 -85.71 -95.36 0.08 Allowed 'General case' 0 N--CA 1.435 -1.203 0 C-N-CA 123.679 0.792 . . . . 0.0 111.987 -173.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . 0.423 ' H ' ' CG ' ' A' ' 133' ' ' ASP . 36.9 mt-10 -99.84 136.67 39.41 Favored 'General case' 0 N--CA 1.434 -1.248 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 176.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -103.86 116.01 31.5 Favored 'General case' 0 C--N 1.294 -1.831 0 CA-C-O 121.618 0.723 . . . . 0.0 111.219 -176.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -122.65 130.01 52.49 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.332 -177.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -87.51 151.64 22.85 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 16.7 tpt -58.78 -30.51 67.62 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.124 0.488 . . . . 0.0 111.109 178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 29.8 m -96.93 9.95 40.51 Favored 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.15 -0.344 . . . . 0.0 111.546 -179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 60.4 tp -84.28 -53.99 5.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.024 0.44 . . . . 0.0 110.305 -179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 C--N 1.308 -1.228 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.597 -179.928 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.3 m . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 119.983 -0.056 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.6 m120 -144.29 153.3 41.87 Favored 'General case' 0 CA--C 1.502 -0.896 0 O-C-N 122.071 -0.393 . . . . 0.0 111.065 -176.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.18 79.94 1.8 Allowed 'General case' 0 C--N 1.295 -1.804 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 53.2 mt -81.67 79.12 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-O 122.085 0.945 . . . . 0.0 109.944 -174.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 87.0 mt -104.16 84.16 2.19 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 114.422 -1.263 . . . . 0.0 108.654 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.7 72.98 0.18 Allowed 'General case' 0 N--CA 1.43 -1.473 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.86 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.9 t -81.38 -24.41 37.02 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 63.9 mtt -142.98 140.06 30.9 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 104.988 -2.227 . . . . 0.0 104.988 175.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -86.4 73.85 10.06 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 120.032 -0.667 . . . . 0.0 109.279 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.2 m -111.76 122.83 36.14 Favored Pre-proline 0 N--CA 1.424 -1.774 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.688 179.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -80.79 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.444 -1.407 0 C-N-CA 122.183 1.922 . . . . 0.0 111.73 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -149.52 141.06 23.39 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -133.25 80.83 0.32 Allowed Glycine 0 C--N 1.289 -2.05 0 C-N-CA 120.54 -0.838 . . . . 0.0 111.598 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -91.21 16.19 1.61 Allowed 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 122.545 2.163 . . . . 0.0 111.407 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.6 -66.02 0.28 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.428 1.491 . . . . 0.0 112.704 178.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 127.63 -127.64 5.87 Favored Glycine 0 N--CA 1.432 -1.631 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -119.28 133.48 10.15 Favored Glycine 0 C--N 1.302 -1.353 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 28.9 pt20 -88.65 -23.97 22.9 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.033 0.444 . . . . 0.0 111.314 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -89.81 -72.58 0.55 Allowed 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 55.2 t -117.12 111.05 33.35 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.557 0 N-CA-C 106.061 -1.829 . . . . 0.0 106.061 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.48 ' O ' HG12 ' A' ' 25' ' ' VAL . 25.0 t70 -76.42 116.57 17.23 Favored 'General case' 0 C--N 1.302 -1.496 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.713 178.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.19 -37.0 66.51 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -177.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -86.29 -25.31 25.56 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.249 0.547 . . . . 0.0 111.067 -175.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -75.14 -35.45 61.66 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.855 177.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.48 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.7 p -88.78 -43.41 15.12 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.029 0 C-N-CA 120.829 -0.348 . . . . 0.0 111.484 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.402 ' HG ' HG13 ' A' ' 25' ' ' VAL . 86.5 mt -104.63 115.44 30.34 Favored 'General case' 0 CA--C 1.501 -0.933 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.601 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 17.1 p -97.78 154.1 37.99 Favored Pre-proline 0 N--CA 1.418 -2.037 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.285 -176.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -59.03 -29.19 89.96 Favored 'Trans proline' 0 C--N 1.36 1.149 0 C-N-CA 123.012 2.475 . . . . 0.0 112.908 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.601 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 4.1 pm0 -66.44 -39.41 88.88 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 120.746 0.308 . . . . 0.0 111.387 178.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.478 HG21 ' SD ' ' A' ' 115' ' ' MET . 51.6 mt -68.53 -44.06 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.984 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.563 ' SD ' HD13 ' A' ' 74' ' ' LEU 0.268 15.1 ptp -93.04 7.56 43.6 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 115.197 1.554 . . . . 0.0 115.197 -175.629 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.413 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.49 -53.48 64.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 CA-C-O 119.373 -0.346 . . . . 0.0 111.208 175.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -66.78 -21.18 51.48 Favored 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 121.685 1.59 . . . . 0.0 112.319 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 73.4 mt -76.74 -54.57 12.9 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.7 mp -67.92 -15.99 63.87 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.53 -4.78 41.81 Favored 'General case' 0 C--O 1.243 0.719 0 CA-C-O 121.397 0.618 . . . . 0.0 110.875 177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.498 ' O ' HG22 ' A' ' 40' ' ' VAL . 23.8 t-20 -88.24 122.45 31.79 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 107.343 -1.354 . . . . 0.0 107.343 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' GLN . . . -72.62 -26.1 61.55 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.48 -38.08 71.24 Favored 'General case' 0 C--O 1.266 1.932 0 CA-C-O 121.849 0.833 . . . . 0.0 110.002 -177.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 17.8 m -68.98 -33.77 60.69 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.274 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 174.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.482 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 74.3 mt-30 -59.59 -37.45 78.59 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.91 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -58.0 -38.94 77.08 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.378 177.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -71.29 -27.34 63.35 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.6 mp -82.06 -26.63 33.54 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-O 120.814 0.34 . . . . 0.0 111.77 -178.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 85.4 mt -51.04 -44.93 88.13 Favored Pre-proline 0 CA--C 1.557 1.24 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -60.19 -13.63 24.92 Favored 'Trans proline' 0 C--N 1.368 1.576 0 C-N-CA 122.072 1.848 . . . . 0.0 112.987 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.516 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 65.9 m-85 -114.66 3.8 14.88 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 122.999 0.52 . . . . 0.0 111.374 -178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.444 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 51.2 tp -52.4 122.45 25.31 Favored Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 124.38 1.072 . . . . 0.0 113.28 -174.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.462 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 16.5 Cg_exo -71.28 140.69 37.61 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 122.783 2.322 . . . . 0.0 110.492 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 49.5 m -65.16 138.7 58.44 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 123.001 0.52 . . . . 0.0 112.179 -178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 99.89 -36.1 4.32 Favored Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 116.16 -0.473 . . . . 0.0 112.393 177.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -90.71 165.95 13.41 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-O 121.523 0.677 . . . . 0.0 111.763 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.5 m -146.77 162.77 37.87 Favored 'General case' 0 C--N 1.29 -1.996 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 60.7 mt -89.74 120.75 69.46 Favored Pre-proline 0 C--N 1.298 -1.672 0 O-C-N 123.283 0.364 . . . . 0.0 111.442 -178.082 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.483 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 12.6 Cg_exo -71.38 147.42 52.66 Favored 'Trans proline' 0 CA--C 1.545 1.066 0 C-N-CA 122.954 2.436 . . . . 0.0 111.659 177.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.06 -65.72 0.97 Allowed 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -176.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.46 ' O ' HG13 ' A' ' 61' ' ' ILE . 60.5 p -86.63 161.68 18.35 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 111.643 0.238 . . . . 0.0 111.643 -176.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -60.55 -33.91 73.37 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.196 0.198 . . . . 0.0 110.967 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -52.61 -54.5 32.26 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.207 1.003 . . . . 0.0 110.748 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.808 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 10.1 pt-20 -74.63 -29.05 61.14 Favored 'General case' 0 N--CA 1.426 -1.637 0 CA-C-N 114.493 -1.23 . . . . 0.0 111.151 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 57' ' ' THR . 83.3 mt -63.18 -48.1 89.22 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.835 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 174.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.6 mm-40 -64.36 -38.33 90.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.808 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.1 p30 -80.18 -30.69 38.8 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 119.255 -0.978 . . . . 0.0 112.6 -176.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.6 m -91.03 -37.75 13.24 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.278 -176.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 49.8 mt -112.1 74.53 0.87 Allowed 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 12.8 m -94.55 -51.62 4.67 Favored 'General case' 0 N--CA 1.427 -1.602 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.134 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.515 ' HB3' ' HD3' ' A' ' 68' ' ' PRO . 29.4 t -145.0 -63.89 0.02 OUTLIER Pre-proline 0 CA--C 1.552 1.032 0 CA-C-O 118.386 -0.816 . . . . 0.0 112.684 178.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 45.1 Cg_exo -59.32 -57.07 1.0 Allowed 'Trans proline' 0 C--N 1.383 2.38 0 C-N-CA 121.547 1.498 . . . . 0.0 112.336 -177.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -72.81 -19.84 61.26 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.702 179.694 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -69.69 -44.88 69.54 Favored 'General case' 0 C--O 1.2 -1.501 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.07 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 91.8 mt-30 -63.31 -32.01 73.31 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 120.893 0.377 . . . . 0.0 110.707 177.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -67.1 -50.66 60.82 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.317 0.58 . . . . 0.0 109.531 176.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.08 -40.86 95.24 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.848 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 31' ' ' MET . 22.1 tp -69.37 -26.48 64.69 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.84 179.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.69 -48.91 62.94 Favored Glycine 0 N--CA 1.442 -0.938 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 174.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.516 ' HB2' ' HB2' ' A' ' 47' ' ' TYR . 24.6 ptt? -69.02 -31.29 69.99 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.839 177.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -58.47 -54.22 49.46 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 45.6 m -61.11 -35.91 78.29 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.25 179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.69 -45.44 82.79 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.3 179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.21 -31.58 72.05 Favored 'General case' 0 C--O 1.25 1.081 0 CA-C-O 121.642 0.735 . . . . 0.0 110.294 178.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.408 HD22 HG12 ' A' ' 108' ' ' VAL . 5.9 tt -68.99 -43.72 74.3 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.949 178.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.86 -33.49 73.15 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 122.938 0.495 . . . . 0.0 111.97 -179.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.7 m -77.91 -18.92 55.58 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 121.212 0.529 . . . . 0.0 111.01 177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.24 1.16 75.89 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.884 -178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -68.99 -29.26 67.43 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 121.331 0.586 . . . . 0.0 110.647 -178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.484 HD11 ' HB ' ' A' ' 40' ' ' VAL . 23.0 tp -98.59 5.74 47.6 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.213 -176.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -65.45 -66.56 2.38 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-N 115.302 -0.863 . . . . 0.0 114.885 -176.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -52.67 -27.09 32.07 Favored 'Trans proline' 0 C--N 1.363 1.328 0 C-N-CA 123.763 2.975 . . . . 0.0 114.67 -176.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -67.52 -31.04 70.88 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.379 -177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.0 mmt -67.43 -27.65 67.24 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.99 0.424 . . . . 0.0 112.096 -176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.501 ' HB2' HG21 ' A' ' 100' ' ' VAL . 48.3 t -68.52 -32.88 73.15 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -71.71 -26.35 62.45 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.224 -177.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' ' 95' ' ' LEU . 62.8 m-85 -82.35 -7.95 59.63 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.999 0.428 . . . . 0.0 111.019 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 80.23 36.52 23.97 Favored Glycine 0 N--CA 1.437 -1.265 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 -179.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.443 HD13 ' HB2' ' A' ' 93' ' ' PHE . 6.2 mp -81.45 152.87 70.75 Favored Pre-proline 0 C--N 1.306 -1.293 0 O-C-N 122.727 -0.278 . . . . 0.0 110.751 178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -49.47 145.21 16.81 Favored 'Trans proline' 0 C--O 1.244 0.82 0 C-N-CA 123.411 2.741 . . . . 0.0 112.311 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -58.97 -35.81 73.8 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 123.456 0.702 . . . . 0.0 111.387 -177.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -69.79 -37.23 76.25 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.541 179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.35 -47.22 62.0 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.571 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.501 HG21 ' HB2' ' A' ' 91' ' ' CYS . 9.9 p -67.06 -34.03 67.07 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 120.491 -0.484 . . . . 0.0 111.504 -179.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -59.36 -48.6 81.0 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.41 -38.61 84.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.207 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.63 -33.39 75.55 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.813 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -76.8 -39.29 51.98 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.094 0.474 . . . . 0.0 111.139 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -79.54 -23.82 42.6 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.789 -178.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.95 24.84 8.79 Favored Glycine 0 N--CA 1.436 -1.318 0 C-N-CA 120.619 -0.8 . . . . 0.0 113.637 173.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -103.9 102.58 12.38 Favored 'General case' 0 C--N 1.313 -1.005 0 C-N-CA 120.108 -0.637 . . . . 0.0 109.285 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.408 HG12 HD22 ' A' ' 81' ' ' LEU . 19.5 m -68.9 -26.26 32.15 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.477 -176.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -75.29 -47.34 28.37 Favored 'General case' 0 N--CA 1.436 -1.141 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.709 -176.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.82 -33.16 75.34 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.66 0.384 . . . . 0.0 110.018 178.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -64.81 -49.01 72.32 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 176.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.409 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -57.85 -42.07 83.7 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.454 178.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 63.3 mttp -61.32 -64.25 1.01 Allowed 'General case' 0 CA--C 1.486 -1.489 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.962 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.77 -28.82 70.24 Favored 'General case' 0 N--CA 1.417 -2.081 0 CA-C-N 114.498 -1.228 . . . . 0.0 113.026 -169.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.478 ' SD ' HG21 ' A' ' 30' ' ' ILE . 48.2 ttm -66.08 -59.43 3.8 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.205 177.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.261 3.7 pp0? -72.06 -24.71 61.56 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 119.168 -1.013 . . . . 0.0 112.867 -176.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -70.24 -42.5 72.13 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.257 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -104.93 -27.29 11.79 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -173.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -82.73 65.56 7.92 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -172.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.74 125.07 0.27 Allowed Pre-proline 0 C--N 1.307 -1.267 0 C-N-CA 125.418 1.487 . . . . 0.0 107.805 170.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -92.48 7.74 2.97 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.446 2.098 . . . . 0.0 112.096 -177.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -82.73 -8.86 59.56 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 113.58 0.955 . . . . 0.0 113.58 -174.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 20.5 tm0? -66.45 120.81 14.0 Favored 'General case' 0 C--O 1.243 0.742 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 179.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 pttp -148.17 168.24 22.97 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.058 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -166.98 -40.85 0.02 OUTLIER 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 96.08 25.68 12.46 Favored Glycine 0 N--CA 1.441 -1.004 0 CA-C-N 115.509 -0.769 . . . . 0.0 112.043 177.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -88.28 96.61 10.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.559 0.695 . . . . 0.0 109.39 179.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 5.0 m -118.0 -13.7 10.01 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.377 -176.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.474 ' C ' ' H ' ' A' ' 131' ' ' LYS . 3.6 mptp? 63.04 35.69 12.9 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.703 0.763 . . . . 0.0 110.025 -174.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -79.85 27.59 0.3 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.565 1.146 . . . . 0.0 110.063 179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.474 ' H ' ' C ' ' A' ' 129' ' ' LYS . 38.0 ttpt -87.74 129.14 35.26 Favored 'General case' 0 N--CA 1.423 -1.795 0 CA-C-N 114.209 -1.36 . . . . 0.0 109.265 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -137.68 140.34 40.74 Favored 'General case' 0 C--N 1.294 -1.805 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 176.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 63.59 -115.19 0.44 Allowed 'General case' 0 C--O 1.243 0.732 0 O-C-N 123.801 0.688 . . . . 0.0 109.319 -177.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 66.68 -65.79 0.2 Allowed 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.166 1.386 . . . . 0.0 112.663 176.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 41.8 tt0 -166.94 -36.22 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.298 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -172.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 135' ' ' GLU . 12.7 pt-20 63.9 -0.12 0.85 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 127.541 2.336 . . . . 0.0 114.47 174.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 27.1 t70 61.65 92.77 0.05 Allowed 'General case' 0 C--O 1.241 0.628 0 C-N-CA 124.823 1.249 . . . . 0.0 111.342 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 26.6 ttt -104.13 89.68 3.35 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.569 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -62.22 -39.49 92.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.571 -177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -144.63 -63.17 0.36 Allowed 'General case' 0 N--CA 1.428 -1.569 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.6 t70 . . . . . 0 C--N 1.307 -1.272 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.642 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.2 m . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.705 ' HB3' ' HB2' ' A' ' 38' ' ' ALA . 31.0 p-10 -71.23 111.15 6.34 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 122.816 1.293 . . . . 0.0 113.441 -177.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.34 34.13 1.07 Allowed 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 104.472 -2.418 . . . . 0.0 104.472 173.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.1 mt -49.19 119.26 0.74 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.591 0 CA-C-N 112.816 -1.993 . . . . 0.0 113.049 -170.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.7 mt -86.97 139.93 30.1 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.561 -1.2 . . . . 0.0 110.789 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -87.49 92.3 9.04 Favored 'General case' 0 N--CA 1.422 -1.826 0 N-CA-C 105.912 -1.884 . . . . 0.0 105.912 171.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -66.3 -30.22 70.6 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 121.774 0.797 . . . . 0.0 109.534 -175.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -170.43 145.95 2.73 Favored 'General case' 0 CA--C 1.487 -1.47 0 N-CA-C 103.591 -2.744 . . . . 0.0 103.591 172.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.545 ' OD1' ' HA ' ' A' ' 50' ' ' SER . 18.4 t-20 -134.87 72.08 1.45 Allowed 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 118.636 -1.226 . . . . 0.0 111.642 -178.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 42.3 t -138.95 71.68 41.45 Favored Pre-proline 0 CA--C 1.55 0.964 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 173.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -96.19 -18.01 0.3 Allowed 'Trans proline' 0 N--CA 1.448 -1.184 0 C-N-CA 121.992 1.794 . . . . 0.0 114.107 -177.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.59 72.57 0.51 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.06 0.944 . . . . 0.0 110.574 -171.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.489 ' HA3' ' HA ' ' A' ' 47' ' ' TYR . . . -105.1 105.59 2.54 Favored Glycine 0 N--CA 1.429 -1.782 0 CA-C-N 114.342 -1.299 . . . . 0.0 111.664 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -95.67 168.64 1.34 Allowed 'Trans proline' 0 N--CA 1.437 -1.8 0 C-N-CA 122.751 2.301 . . . . 0.0 112.008 179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -98.14 91.33 5.22 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 175.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.86 -53.83 40.1 Favored Glycine 0 CA--C 1.504 -0.627 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.339 -178.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -92.72 125.55 8.19 Favored Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 178.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -156.82 102.27 2.01 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-O 121.428 0.633 . . . . 0.0 110.464 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 20' ' ' VAL . 8.7 tt0 -145.55 144.94 30.81 Favored 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 176.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.401 ' HB ' ' O ' ' A' ' 19' ' ' GLN . 77.6 t 73.61 144.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 O-C-N 124.469 1.106 . . . . 0.0 109.43 -172.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.405 ' O ' HG12 ' A' ' 25' ' ' VAL . 38.1 t70 -76.49 94.14 3.65 Favored 'General case' 0 CA--C 1.5 -0.946 0 O-C-N 121.279 -0.888 . . . . 0.0 109.082 177.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.405 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -56.57 -32.43 65.18 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.432 -1.258 . . . . 0.0 113.886 -174.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -68.69 -27.14 65.69 Favored 'General case' 0 C--N 1.31 -1.121 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 m -95.89 -29.67 14.07 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.234 -0.586 . . . . 0.0 111.859 -179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.48 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.2 p -84.13 -38.15 13.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-O 121.007 0.432 . . . . 0.0 110.634 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.447 ' HG ' HG13 ' A' ' 25' ' ' VAL . 88.0 mt -111.67 97.46 6.73 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 178.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 3.4 p -92.06 156.81 41.88 Favored Pre-proline 0 C--N 1.292 -1.904 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -173.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -51.7 -30.35 36.87 Favored 'Trans proline' 0 C--N 1.374 1.903 0 C-N-CA 124.016 3.144 . . . . 0.0 113.684 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.418 ' HG3' HG13 ' A' ' 30' ' ' ILE . 10.7 pt-20 -61.17 -35.44 77.14 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 123.167 0.587 . . . . 0.0 111.314 177.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.422 HG21 ' SD ' ' A' ' 115' ' ' MET . 56.4 mt -83.17 -37.29 13.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-O 121.986 0.898 . . . . 0.0 108.985 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.1 mmt -78.81 -9.97 59.63 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -174.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -58.53 -58.33 19.94 Favored Pre-proline 0 CA--C 1.553 1.064 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -71.01 -26.05 22.15 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 121.275 1.317 . . . . 0.0 112.248 -179.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.8 mt -72.25 -60.66 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.051 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.407 -177.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -72.36 -10.59 59.98 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 -175.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.96 -13.46 58.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.972 0.415 . . . . 0.0 110.267 176.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.441 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 37.4 t30 -84.03 119.98 25.59 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.239 -178.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.705 ' HB2' ' HB3' ' A' ' 2' ' ' ASN . . . -50.2 -35.8 27.99 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.345 1.458 . . . . 0.0 111.962 -178.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 28.9 t70 -59.97 -43.5 95.05 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 114.097 -1.411 . . . . 0.0 111.389 -177.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 37' ' ' ASN . 5.3 m -78.56 -29.43 14.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 C-N-CA 119.995 -0.682 . . . . 0.0 109.341 179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.647 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 82.4 mt-30 -61.07 -42.12 97.91 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -51.68 -45.86 63.6 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.385 173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -74.22 -27.57 60.85 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.14 -22.29 31.09 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 81.6 mt -45.66 -51.11 30.27 Favored Pre-proline 0 CA--C 1.561 1.365 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -65.82 -13.32 39.26 Favored 'Trans proline' 0 C--N 1.37 1.686 0 C-N-CA 121.782 1.654 . . . . 0.0 113.181 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.489 ' HA ' ' HA3' ' A' ' 13' ' ' GLY . 57.9 m-85 -114.6 1.19 14.18 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 120.849 0.356 . . . . 0.0 111.373 -176.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.679 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 5.0 tt -63.48 130.73 94.51 Favored Pre-proline 0 C--N 1.319 -0.731 0 C-N-CA 123.662 0.785 . . . . 0.0 111.288 -173.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_exo -50.69 126.54 18.48 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 123.411 2.741 . . . . 0.0 112.015 177.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.545 ' HA ' ' OD1' ' A' ' 9' ' ' ASN . 32.3 m -60.6 124.93 21.86 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -172.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 102.21 -7.43 54.43 Favored Glycine 0 N--CA 1.435 -1.371 0 CA-C-N 114.777 -1.102 . . . . 0.0 113.36 175.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -117.24 -174.21 2.56 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 117.263 0.531 . . . . 0.0 111.231 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.7 p -146.11 179.54 7.42 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 120.575 0.226 . . . . 0.0 111.416 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 15.7 mt -104.88 128.84 25.95 Favored Pre-proline 0 C--N 1.317 -0.831 0 C-N-CA 123.07 0.548 . . . . 0.0 111.044 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_exo -62.18 134.79 50.91 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 122.13 1.887 . . . . 0.0 109.447 173.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -86.65 -13.88 44.27 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 120.752 0.311 . . . . 0.0 111.691 -173.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.428 ' O ' HG13 ' A' ' 61' ' ' ILE . 33.5 p -126.16 151.07 47.8 Favored 'General case' 0 C--O 1.245 0.832 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.685 -178.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.06 78.12 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.245 0.618 . . . . 0.0 112.338 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -63.85 -44.05 94.29 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.029 0.443 . . . . 0.0 110.735 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -71.18 -25.19 62.43 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.239 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 57' ' ' THR . 63.7 mt -62.85 -42.26 95.73 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 173.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 -67.76 -19.79 65.15 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.757 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -86.14 -60.91 1.87 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.166 0.508 . . . . 0.0 111.598 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 24.0 m -73.06 -37.19 66.92 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.44 -173.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 61' ' ' ILE . 53.1 mt -106.63 76.56 1.13 Allowed 'General case' 0 N--CA 1.432 -1.354 0 O-C-N 121.548 -0.72 . . . . 0.0 110.146 -176.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.1 p -89.8 -60.76 1.85 Allowed 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.306 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.3 m -144.81 -62.43 0.02 OUTLIER Pre-proline 0 CA--C 1.562 1.413 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 179.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -62.84 -56.04 0.69 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 121.479 1.453 . . . . 0.0 112.185 -178.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -69.74 -23.71 63.43 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -66.75 -46.4 75.51 Favored 'General case' 0 C--O 1.211 -0.94 0 CA-C-N 115.536 -0.757 . . . . 0.0 110.283 177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -60.85 -36.55 79.42 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-O 120.832 0.349 . . . . 0.0 110.768 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -63.53 -48.41 77.66 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.474 0.654 . . . . 0.0 109.917 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.93 -35.68 78.85 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.367 -179.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.405 HD23 HD13 ' A' ' 22' ' ' LEU . 17.5 tp -77.08 -21.2 54.73 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.13 -47.0 56.17 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 174.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.679 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.3 ptt? -68.72 -30.12 68.7 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.093 0.473 . . . . 0.0 110.408 176.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -61.6 -50.92 70.64 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.8 t -60.75 -38.69 86.04 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.893 179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.93 -50.6 70.18 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.035 177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -30.1 70.99 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-O 121.179 0.514 . . . . 0.0 110.795 179.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.5 tt -67.81 -53.11 29.6 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.71 -31.84 72.83 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.152 0.501 . . . . 0.0 110.855 179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.5 t -65.77 -25.36 67.23 Favored 'General case' 0 CA--C 1.552 1.019 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.612 177.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 90.11 -7.02 82.36 Favored Glycine 0 C--N 1.332 0.317 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.36 179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -75.49 -24.88 56.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.117 0.484 . . . . 0.0 111.034 -178.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 89' ' ' LEU . 25.6 tp -98.21 5.43 48.46 Favored 'General case' 0 C--N 1.308 -1.236 0 CA-C-O 121.42 0.629 . . . . 0.0 109.468 -178.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -62.31 -67.6 2.02 Favored Glycine 0 CA--C 1.525 0.678 0 CA-C-N 115.273 -0.876 . . . . 0.0 114.461 -177.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -58.31 -24.16 66.49 Favored 'Trans proline' 0 C--N 1.362 1.289 0 C-N-CA 123.087 2.525 . . . . 0.0 113.127 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.549 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.4 mp -66.96 -18.17 65.26 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.415 -0.812 . . . . 0.0 112.301 -177.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.46 ' O ' ' HB2' ' A' ' 95' ' ' LEU . 24.1 mmt -76.78 -20.8 56.02 Favored 'General case' 0 C--N 1.308 -1.21 0 O-C-N 121.574 -0.704 . . . . 0.0 111.877 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . 0.494 ' HB2' HG21 ' A' ' 100' ' ' VAL . 26.1 t -74.7 -29.78 61.32 Favored 'General case' 0 N--CA 1.439 -0.985 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 -178.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.549 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.7 pt20 -82.64 3.38 29.14 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.018 -174.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -111.03 3.68 18.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.322 0.582 . . . . 0.0 109.846 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.68 22.33 72.62 Favored Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.923 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 90' ' ' MET . 6.6 mp -74.97 150.22 85.77 Favored Pre-proline 0 C--N 1.314 -0.938 0 O-C-N 122.709 -0.289 . . . . 0.0 111.239 179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -47.89 146.57 8.55 Favored 'Trans proline' 0 C--O 1.245 0.85 0 C-N-CA 124.021 3.148 . . . . 0.0 113.301 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.451 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.55 -32.19 70.12 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 123.522 0.729 . . . . 0.0 109.763 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -59.91 -50.21 74.67 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.909 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -66.46 -48.36 70.19 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-N 114.52 -1.218 . . . . 0.0 111.491 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.494 HG21 ' HB2' ' A' ' 91' ' ' CYS . 12.5 p -65.84 -33.64 64.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.77 -178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -63.71 -47.14 82.32 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.8 84.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.827 178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -66.76 -36.87 83.44 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.405 179.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 26.7 m-80 -73.73 -30.48 62.85 Favored 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.034 0.445 . . . . 0.0 111.6 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 105' ' ' LYS . 32.2 mmtp -88.47 -12.24 43.62 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.342 0.591 . . . . 0.0 111.516 -179.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 84.23 29.11 31.66 Favored Glycine 0 N--CA 1.431 -1.659 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.682 171.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.93 112.59 25.63 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 21.8 m -76.89 -36.43 25.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.145 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.601 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.03 -35.46 61.92 Favored 'General case' 0 N--CA 1.445 -0.712 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.88 -176.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.09 -41.42 97.29 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.138 177.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -61.08 -49.98 75.15 Favored 'General case' 0 C--O 1.241 0.649 0 O-C-N 123.411 0.444 . . . . 0.0 110.677 178.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.08 87.27 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.778 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -64.36 -46.74 82.09 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.513 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.76 -38.45 90.6 Favored 'General case' 0 N--CA 1.437 -1.1 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.353 -177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.422 ' SD ' HG21 ' A' ' 30' ' ' ILE . 56.1 ttm -61.22 -55.06 36.42 Favored 'General case' 0 C--N 1.318 -0.785 0 O-C-N 123.155 0.284 . . . . 0.0 110.913 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.48 ' HG2' HG23 ' A' ' 25' ' ' VAL . 0.9 OUTLIER -68.85 -30.28 68.77 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -176.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -74.91 -34.92 62.23 Favored 'General case' 0 CA--C 1.501 -0.912 0 CA-C-O 120.923 0.392 . . . . 0.0 111.897 178.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 40.2 m-80 -96.85 -56.2 2.64 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -173.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -169.93 108.31 0.38 Allowed 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -171.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -127.58 85.78 60.02 Favored Pre-proline 0 C--N 1.302 -1.48 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -103.05 25.85 0.11 Allowed 'Trans proline' 0 N--CA 1.451 -0.996 0 C-N-CA 123.128 2.552 . . . . 0.0 113.261 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -73.13 -47.08 47.19 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -172.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.545 HE22 ' HB2' ' A' ' 125' ' ' GLU . 0.0 OUTLIER -91.91 107.12 18.98 Favored 'General case' 0 C--N 1.293 -1.872 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 -179.153 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -116.1 81.18 1.56 Allowed 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.204 0.526 . . . . 0.0 111.976 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.545 ' HB2' HE22 ' A' ' 123' ' ' GLN . 0.2 OUTLIER -145.02 97.45 3.02 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 105.47 -2.048 . . . . 0.0 105.47 174.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 153.74 40.93 0.02 OUTLIER Glycine 0 C--N 1.283 -2.37 0 N-CA-C 108.522 -1.831 . . . . 0.0 108.522 -176.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -64.15 110.55 2.22 Favored 'General case' 0 CA--C 1.497 -1.074 0 CA-C-N 114.17 -1.015 . . . . 0.0 109.702 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 10.4 m -117.73 97.98 6.13 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-O 121.265 0.555 . . . . 0.0 110.252 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 55.9 mtpt -90.47 -9.81 46.04 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.655 0.741 . . . . 0.0 109.692 177.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -89.54 129.77 35.96 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.668 -174.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -95.77 -53.51 3.67 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.213 -175.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 61.3 tttp -148.38 138.49 22.5 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -95.44 139.98 30.95 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -99.35 15.3 26.73 Favored 'General case' 0 C--N 1.292 -1.921 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.913 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -80.69 -36.08 32.77 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -74.51 109.22 7.81 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 172.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.0 133.03 39.22 Favored 'General case' 0 C--N 1.298 -1.67 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 177.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.5 ptm -129.62 25.61 5.37 Favored 'General case' 0 C--N 1.283 -2.315 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 177.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 18.3 m -83.27 -53.74 5.53 Favored 'General case' 0 N--CA 1.437 -1.119 0 N-CA-C 107.367 -1.346 . . . . 0.0 107.367 178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.461 ' H ' HD23 ' A' ' 140' ' ' LEU . 1.3 pt? -107.95 74.07 0.93 Allowed 'General case' 0 N--CA 1.425 -1.684 0 CA-C-O 121.993 0.902 . . . . 0.0 108.975 175.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.5 t70 . . . . . 0 C--N 1.304 -1.38 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.53 -177.99 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -103.08 -165.11 1.14 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 81.46 34.52 0.1 Allowed 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.848 1.259 . . . . 0.0 111.536 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.3 mp -85.44 81.57 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 106.112 -1.81 . . . . 0.0 106.112 174.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -104.71 117.28 33.69 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.013 -172.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -135.9 86.37 2.23 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.509 HG23 ' H ' ' A' ' 9' ' ' ASN . 15.1 t -108.8 -28.82 8.98 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.483 -174.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 25.6 ptt? 54.33 24.17 4.91 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 125.269 1.428 . . . . 0.0 113.243 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.509 ' H ' HG23 ' A' ' 7' ' ' THR . 78.0 m-20 -84.37 111.62 19.6 Favored 'General case' 0 CA--C 1.498 -1.02 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.742 178.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -152.16 95.15 3.19 Favored Pre-proline 0 C--N 1.292 -1.929 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 173.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -95.83 -174.32 0.28 Allowed 'Trans proline' 0 N--CA 1.44 -1.622 0 C-N-CA 122.423 2.082 . . . . 0.0 112.017 -178.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -93.15 76.43 4.63 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 175.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -87.62 118.3 4.97 Favored Glycine 0 N--CA 1.425 -2.067 0 CA-C-N 114.619 -1.173 . . . . 0.0 111.347 -177.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -76.6 93.69 1.05 Allowed 'Trans proline' 0 N--CA 1.444 -1.411 0 C-N-CA 122.234 1.956 . . . . 0.0 110.156 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -144.51 174.03 11.29 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 122.75 33.13 0.88 Allowed Glycine 0 C--N 1.3 -1.467 0 N-CA-C 111.464 -0.654 . . . . 0.0 111.464 -176.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.59 28.94 3.55 Favored Glycine 0 C--N 1.317 -0.476 0 C-N-CA 120.9 -0.667 . . . . 0.0 113.892 178.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -141.59 158.09 44.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 117.187 0.494 . . . . 0.0 110.058 179.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 62.64 30.77 16.96 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.983 1.313 . . . . 0.0 110.103 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.452 HG21 ' HG2' ' A' ' 109' ' ' GLU . 61.5 t 60.27 80.11 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.533 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 -171.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.9 t70 -67.05 97.61 0.52 Allowed 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.128 -174.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.427 HD13 HD23 ' A' ' 74' ' ' LEU . 1.2 pp -55.35 -36.56 66.44 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 114.504 1.298 . . . . 0.0 114.504 -177.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.43 -26.63 55.7 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -175.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.9 p -88.23 -29.7 20.25 Favored 'General case' 0 C--N 1.311 -1.076 0 C-N-CA 120.522 -0.471 . . . . 0.0 111.806 179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 7.1 p -84.0 -44.95 18.29 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.4 177.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.422 ' HG ' HG13 ' A' ' 25' ' ' VAL . 92.8 mt -109.63 111.19 22.52 Favored 'General case' 0 N--CA 1.437 -1.124 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 12.4 p -92.88 155.63 41.36 Favored Pre-proline 0 N--CA 1.421 -1.909 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.022 -174.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.97 -29.57 36.25 Favored 'Trans proline' 0 C--N 1.363 1.322 0 C-N-CA 123.752 2.968 . . . . 0.0 113.589 -179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -58.57 -37.67 76.25 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 122.898 0.479 . . . . 0.0 110.642 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.9 mt -76.69 -36.88 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.804 0 CA-C-O 121.9 0.857 . . . . 0.0 108.926 -177.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.438 ' HB3' HD13 ' A' ' 35' ' ' LEU . 24.2 mmt -81.6 -8.8 59.76 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 114.707 -1.133 . . . . 0.0 112.734 -173.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -63.73 -57.42 19.33 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.162 179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.88 -20.76 29.16 Favored 'Trans proline' 0 C--N 1.371 1.734 0 C-N-CA 121.038 1.158 . . . . 0.0 112.182 178.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.457 ' HA ' ' CE1' ' A' ' 93' ' ' PHE . 68.8 mt -76.86 -55.81 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.653 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.123 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.438 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.2 mp -73.18 -13.83 61.24 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -177.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.62 -8.86 57.66 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-O 121.512 0.673 . . . . 0.0 110.301 176.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 30.1 t30 -89.82 115.49 27.2 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.81 -19.3 65.84 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-O 121.245 0.545 . . . . 0.0 112.142 -174.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -63.61 -45.24 91.26 Favored 'General case' 0 C--O 1.257 1.469 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.778 177.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 11.0 m -72.44 -33.13 44.56 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.471 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.546 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 78.4 mt-30 -58.76 -37.33 76.01 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.959 177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -47.13 86.47 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 178.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.414 ' HD2' ' N ' ' A' ' 43' ' ' ARG . 1.0 OUTLIER -73.51 -24.88 60.21 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.18 -23.2 35.62 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 177.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 45.5 mt -49.12 -47.2 76.0 Favored Pre-proline 0 CA--C 1.552 1.051 0 N-CA-C 115.513 1.671 . . . . 0.0 115.513 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -64.79 -20.34 64.78 Favored 'Trans proline' 0 C--N 1.361 1.225 0 C-N-CA 121.413 1.409 . . . . 0.0 112.22 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -107.12 2.4 24.86 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.203 -175.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.527 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.9 tm? -56.73 113.15 5.48 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.473 1.109 . . . . 0.0 108.681 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -65.23 157.2 58.93 Favored 'Trans proline' 0 C--N 1.359 1.121 0 C-N-CA 122.829 2.353 . . . . 0.0 112.742 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.7 m -60.84 116.01 4.12 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.167 -175.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 101.81 -18.31 52.89 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.994 -0.622 . . . . 0.0 113.508 176.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -78.46 176.99 8.87 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.121 0.486 . . . . 0.0 110.293 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 t -160.24 -178.49 7.0 Favored 'General case' 0 N--CA 1.419 -1.979 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 41' ' ' GLN . 94.7 mt -114.02 123.02 33.47 Favored Pre-proline 0 C--N 1.277 -2.545 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.396 -176.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -75.83 140.78 23.61 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.165 1.91 . . . . 0.0 109.345 170.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -76.37 -54.78 6.27 Favored 'General case' 0 C--N 1.308 -1.209 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -175.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.1 p -104.84 158.59 16.42 Favored 'General case' 0 N--CA 1.42 -1.956 0 C-N-CA 120.153 -0.619 . . . . 0.0 112.638 -175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.422 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -50.7 -39.51 51.55 Favored 'General case' 0 C--N 1.313 -1.011 0 C-N-CA 125.621 1.568 . . . . 0.0 111.897 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -58.44 -48.47 80.62 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-O 121.912 0.863 . . . . 0.0 109.723 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.777 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 34.7 mt-10 -68.62 -37.47 79.78 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-N 114.267 -1.333 . . . . 0.0 110.136 -177.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 82.4 mt -59.6 -42.85 89.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.144 176.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 28.4 mm-40 -68.51 -30.52 69.35 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 116.224 -0.444 . . . . 0.0 112.06 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.777 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 9.2 p30 -85.57 -43.47 13.47 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.626 -179.198 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 32.4 m -78.71 -48.57 14.69 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 120.957 0.408 . . . . 0.0 111.891 -175.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 85.9 mt -89.49 72.43 7.91 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-O 122.465 1.126 . . . . 0.0 111.49 -174.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.7 p -102.14 134.94 44.59 Favored 'General case' 0 N--CA 1.413 -2.284 0 CA-C-N 113.577 -1.647 . . . . 0.0 108.932 176.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.519 ' O ' ' HG3' ' A' ' 71' ' ' GLN 0.389 21.5 t 30.16 -91.12 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.22 0 C-N-CA 126.659 1.984 . . . . 0.0 116.342 179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -58.67 -47.53 18.39 Favored 'Trans proline' 0 C--N 1.402 3.367 0 CA-C-N 122.319 1.864 . . . . 0.0 113.037 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -67.61 -30.54 70.15 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-O 121.168 0.509 . . . . 0.0 109.908 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -67.94 -41.34 82.65 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.021 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 67' ' ' SER . 50.1 mt-30 -65.04 -35.21 80.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.213 0.53 . . . . 0.0 109.945 178.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -67.87 -45.3 74.91 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.733 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -72.75 -38.38 67.4 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.264 0.554 . . . . 0.0 111.496 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.427 HD23 HD13 ' A' ' 22' ' ' LEU . 30.8 tp -71.74 -20.96 61.82 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.243 0.544 . . . . 0.0 109.603 179.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.63 -46.1 71.45 Favored Glycine 0 N--CA 1.44 -1.078 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 174.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.527 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.2 ptt? -70.28 -29.15 65.84 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.184 0.516 . . . . 0.0 109.806 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -60.98 -51.03 70.99 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.563 174.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 46.9 m -63.59 -33.73 76.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.349 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.89 -47.15 78.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.072 0.463 . . . . 0.0 110.67 177.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.3 -33.13 74.62 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-O 121.254 0.55 . . . . 0.0 110.385 178.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 ' CD2' ' A' ' 111' ' ' PHE . 5.5 tt -65.7 -50.75 63.75 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.119 178.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.57 -29.33 69.96 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.25 0.548 . . . . 0.0 110.94 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.5 t -74.5 -17.48 60.75 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.95 178.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 85.93 -9.06 70.38 Favored Glycine 0 C--O 1.225 -0.412 0 C-N-CA 121.502 -0.38 . . . . 0.0 112.27 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -77.58 -9.36 58.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.262 0.553 . . . . 0.0 112.06 -176.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.44 HD12 HD22 ' A' ' 89' ' ' LEU . 30.6 tp -108.73 7.49 26.4 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.468 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -67.24 -69.83 1.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 114.735 -1.121 . . . . 0.0 114.738 -176.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -57.79 -22.75 54.95 Favored 'Trans proline' 0 C--N 1.359 1.118 0 C-N-CA 123.044 2.496 . . . . 0.0 112.428 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.449 ' HA ' HE21 ' A' ' 92' ' ' GLN . 6.8 mp -66.01 -22.78 66.47 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.246 -176.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.3 mmt -72.9 -17.17 61.54 Favored 'General case' 0 CA--C 1.511 -0.535 0 CA-C-O 121.31 0.576 . . . . 0.0 112.038 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 51.7 t -71.8 -20.95 61.78 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.469 0.652 . . . . 0.0 109.567 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.449 HE21 ' HA ' ' A' ' 89' ' ' LEU . 47.1 mt-30 -76.64 -9.06 58.39 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.128 -179.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.488 ' HB2' HD13 ' A' ' 95' ' ' LEU . 66.0 m-85 -113.4 3.04 15.66 Favored 'General case' 0 C--N 1.315 -0.898 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.4 -176.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.95 35.82 85.13 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.112 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.488 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.0 mp -77.25 152.35 81.68 Favored Pre-proline 0 C--N 1.314 -0.977 0 CA-C-N 115.876 -0.162 . . . . 0.0 111.366 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -51.29 152.77 10.84 Favored 'Trans proline' 0 C--O 1.248 1.009 0 C-N-CA 123.395 2.73 . . . . 0.0 112.57 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -59.64 -37.12 77.8 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.556 179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.91 -44.1 90.66 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 123.58 0.55 . . . . 0.0 109.926 176.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -64.18 -50.48 67.95 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.847 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.6 p -66.07 -32.43 58.07 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 120.701 -0.4 . . . . 0.0 110.852 -178.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.507 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 9.5 tp10 -67.91 -49.31 62.63 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -58.54 -35.39 72.24 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 123.174 0.59 . . . . 0.0 111.481 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.468 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -67.88 -29.98 69.23 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.075 0.464 . . . . 0.0 110.866 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -81.43 -31.41 33.14 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-O 121.028 0.442 . . . . 0.0 110.55 176.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.9 mmtt -72.72 -24.32 60.97 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.414 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.6 36.29 23.4 Favored Glycine 0 N--CA 1.421 -2.348 0 N-CA-C 110.109 -1.197 . . . . 0.0 110.109 -178.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -110.33 107.22 16.88 Favored 'General case' 0 N--CA 1.438 -1.067 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -178.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 31.7 m -76.67 -22.15 15.01 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 CA-C-O 121.346 0.593 . . . . 0.0 111.211 -176.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.452 ' HG2' HG21 ' A' ' 20' ' ' VAL . 29.0 mt-10 -76.38 -50.85 13.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.794 -175.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.83 -37.12 86.55 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.258 177.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.531 ' O ' ' HG3' ' A' ' 115' ' ' MET . 87.8 t80 -61.65 -54.9 36.61 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.386 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -58.76 -37.96 77.4 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.188 -179.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.428 ' HA ' HE21 ' A' ' 116' ' ' GLN . 25.3 ttmm -64.41 -53.17 52.75 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.95 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -61.55 -25.64 67.43 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 115.234 -0.894 . . . . 0.0 112.458 -175.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.531 ' HG3' ' O ' ' A' ' 111' ' ' PHE . 74.7 mtp -75.63 -45.63 36.22 Favored 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 120.129 -0.628 . . . . 0.0 111.325 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.428 HE21 ' HA ' ' A' ' 113' ' ' LYS 0.32 3.1 pp0? -82.96 -7.42 59.67 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -179.368 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 37.7 p30 -98.0 -12.49 21.89 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.772 173.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -123.29 -57.52 1.67 Allowed 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 112.786 0.662 . . . . 0.0 112.786 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.3 -38.72 68.65 Favored 'General case' 0 N--CA 1.472 0.675 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -172.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 8.8 ptpt -136.45 80.51 38.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-O 121.038 0.447 . . . . 0.0 111.559 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -81.85 -0.7 10.5 Favored 'Trans proline' 0 C--O 1.253 1.256 0 C-N-CA 122.587 2.192 . . . . 0.0 111.614 178.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 64.4 -168.28 0.21 Allowed 'General case' 0 C--O 1.254 1.305 0 C-N-CA 124.654 1.181 . . . . 0.0 110.065 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -83.14 84.84 7.33 Favored 'General case' 0 N--CA 1.434 -1.264 0 C-N-CA 119.756 -0.777 . . . . 0.0 108.997 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -84.43 39.3 0.72 Allowed 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.214 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -93.0 -17.7 23.58 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.844 -177.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -88.22 46.95 3.44 Favored Glycine 0 C--O 1.243 0.704 0 N-CA-C 111.156 -0.778 . . . . 0.0 111.156 -178.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -164.99 140.14 5.29 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 9.8 t -118.0 149.77 40.39 Favored 'General case' 0 C--N 1.293 -1.864 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -68.54 -53.86 20.39 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 106.185 -1.783 . . . . 0.0 106.185 176.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 2.3 p30 172.8 -179.21 0.08 Allowed 'General case' 0 CA--C 1.499 -1.005 0 C-N-CA 126.641 1.976 . . . . 0.0 107.868 173.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -143.66 172.91 12.16 Favored 'General case' 0 C--N 1.308 -1.234 0 C-N-CA 120.509 -0.476 . . . . 0.0 111.234 -176.137 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -78.24 123.41 26.9 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.427 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -141.55 106.65 4.96 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 123.623 0.577 . . . . 0.0 109.622 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -139.29 104.21 4.93 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-O 121.803 0.811 . . . . 0.0 110.84 177.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -115.95 -67.67 0.98 Allowed 'General case' 0 C--N 1.294 -1.822 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.8 tm-20 -108.59 -59.93 1.81 Allowed 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 173.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.9 t70 62.4 11.71 4.8 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 125.053 1.341 . . . . 0.0 113.277 169.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . 0.296 23.8 ptt? 48.76 -167.45 0.02 OUTLIER 'General case' 0 C--O 1.245 0.857 0 C-N-CA 124.989 1.316 . . . . 0.0 113.499 -174.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.3 m 70.75 16.55 6.71 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.561 0.744 . . . . 0.0 111.462 -179.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -109.73 -37.51 5.64 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.361 -1.718 . . . . 0.0 106.361 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 . . . . . 0 C--N 1.308 -1.203 0 C-N-CA 126.314 1.846 . . . . 0.0 106.995 173.986 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.437 -1.092 0 CA-C-O 121.155 0.502 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -121.8 114.95 21.79 Favored 'General case' 0 CA--C 1.483 -1.605 0 CA-C-O 120.811 0.339 . . . . 0.0 110.231 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.15 94.41 4.08 Favored 'General case' 0 C--N 1.287 -2.125 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 173.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 42.2 mm -97.66 126.05 50.67 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.839 -175.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 tt -82.52 95.4 7.72 Favored 'General case' 0 N--CA 1.436 -1.139 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.05 121.11 43.47 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.2 m 70.24 99.84 0.06 Allowed 'General case' 0 C--N 1.314 -0.954 0 O-C-N 124.413 1.071 . . . . 0.0 112.378 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -93.48 22.62 5.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.937 178.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.1 t30 77.17 146.26 0.09 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.936 1.694 . . . . 0.0 111.082 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 54.3 t 67.44 80.32 0.22 Allowed Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 124.442 1.097 . . . . 0.0 111.717 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.34 -31.63 27.87 Favored 'Trans proline' 0 C--O 1.249 1.064 0 C-N-CA 122.43 2.087 . . . . 0.0 110.916 175.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 73.67 141.26 0.06 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.711 1.604 . . . . 0.0 112.026 179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 84.05 77.68 1.13 Allowed Glycine 0 N--CA 1.437 -1.26 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.563 -178.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -66.2 -34.44 36.33 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.875 2.383 . . . . 0.0 113.746 -177.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -126.7 -48.66 1.52 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 120.999 0.428 . . . . 0.0 110.8 -178.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 143.62 -96.02 0.19 Allowed Glycine 0 N--CA 1.427 -1.952 0 N-CA-C 109.873 -1.291 . . . . 0.0 109.873 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 67.56 36.93 89.1 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 178.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.5 mm-40 -94.07 110.25 21.96 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -76.2 -55.28 5.72 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 173.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 38.6 t -95.1 75.2 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.42 -1.939 0 CA-C-O 122.214 1.006 . . . . 0.0 109.055 179.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -85.75 109.11 18.41 Favored 'General case' 0 CA--C 1.487 -1.446 0 N-CA-C 107.011 -1.478 . . . . 0.0 107.011 175.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -36.22 63.19 Favored 'General case' 0 C--N 1.308 -1.218 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -174.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.41 -25.25 42.1 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.905 0.383 . . . . 0.0 111.339 -176.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 27.3 m -78.97 -42.85 25.75 Favored 'General case' 0 C--N 1.305 -1.37 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.921 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 7.8 p -81.08 -32.81 12.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.86 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.803 -178.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 90.0 mt -116.65 114.42 24.05 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 14.1 p -93.5 153.08 41.37 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.982 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.66 -36.1 49.46 Favored 'Trans proline' 0 C--N 1.364 1.384 0 C-N-CA 123.774 2.983 . . . . 0.0 114.462 -178.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -61.31 -35.77 78.29 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-O 120.954 0.407 . . . . 0.0 111.868 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 66.8 mt -69.63 -34.24 60.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.817 0.818 . . . . 0.0 109.426 -179.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.46 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.3 mmt -86.11 -8.14 58.09 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.034 -0.985 . . . . 0.0 112.898 -175.041 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.47 ' HB2' ' NE2' ' A' ' 62' ' ' GLN . . . -60.35 -57.07 29.3 Favored Pre-proline 0 CA--C 1.547 0.847 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -178.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -71.49 -19.56 28.33 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 121.293 1.328 . . . . 0.0 112.351 -178.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -77.34 -59.0 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.978 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.023 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.46 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.0 mp -71.01 -15.6 62.57 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -176.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.44 -4.69 38.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.93 0.395 . . . . 0.0 111.189 178.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.51 ' ND2' ' HB3' ' A' ' 39' ' ' ASP . 42.3 t30 -96.35 118.87 33.77 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 177.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.7 63.6 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.535 0.734 . . . . 0.0 111.79 -177.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.51 ' HB3' ' ND2' ' A' ' 37' ' ' ASN . 35.1 t70 -59.19 -42.66 91.39 Favored 'General case' 0 C--O 1.258 1.509 0 C-N-CA 123.847 0.859 . . . . 0.0 110.741 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.5 m -77.95 -30.82 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.532 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.586 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 79.0 mt-30 -60.09 -41.64 92.92 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.408 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -55.29 -37.31 67.15 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.38 0.672 . . . . 0.0 111.663 175.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -77.34 -28.59 53.1 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.8 mp -84.58 -25.68 28.48 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 70.0 mt -47.63 -47.34 60.89 Favored Pre-proline 0 CA--C 1.557 1.247 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -62.89 -22.92 74.18 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.595 1.53 . . . . 0.0 112.388 177.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -106.93 7.21 29.88 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.172 -174.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.53 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 50.7 tp -58.66 122.29 60.01 Favored Pre-proline 0 C--O 1.247 0.94 0 C-N-CA 123.468 0.707 . . . . 0.0 110.89 -178.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 17.4 Cg_exo -66.18 148.68 85.32 Favored 'Trans proline' 0 C--O 1.252 1.182 0 C-N-CA 122.382 2.054 . . . . 0.0 110.787 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 40.7 m -70.99 129.53 39.23 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.598 -178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 95.43 -11.66 68.53 Favored Glycine 0 N--CA 1.437 -1.281 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.1 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -107.77 163.57 12.99 Favored 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 122.265 -0.55 . . . . 0.0 111.093 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -143.06 159.55 42.04 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.263 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 30.5 mt -96.73 117.73 65.69 Favored Pre-proline 0 C--N 1.302 -1.499 0 CA-C-N 115.099 -0.955 . . . . 0.0 109.328 176.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' LEU . 11.5 Cg_exo -75.2 132.56 15.3 Favored 'Trans proline' 0 N--CA 1.454 -0.815 0 C-N-CA 122.409 2.072 . . . . 0.0 111.526 176.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -73.92 -30.42 62.56 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.459 ' O ' HG13 ' A' ' 61' ' ' ILE . 18.1 p -100.0 143.38 30.27 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 120.716 0.293 . . . . 0.0 111.464 -178.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -58.72 -37.15 75.53 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.432 0.693 . . . . 0.0 111.879 -177.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -64.17 -47.29 80.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.785 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -63.03 -29.67 71.0 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.878 179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 57' ' ' THR . 73.1 mt -61.99 -40.64 88.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.47 ' NE2' ' HB2' ' A' ' 32' ' ' ALA . 29.7 mm-40 -70.14 -41.55 73.73 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.905 179.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 67.9 m-20 -68.57 -58.77 3.8 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.99 -1.005 . . . . 0.0 111.528 -177.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 23.7 m -71.95 -43.27 65.49 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.113 -0.494 . . . . 0.0 112.015 -174.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.416 HD12 HG23 ' A' ' 61' ' ' ILE . 73.9 mt -91.53 77.18 5.74 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.62 -0.832 . . . . 0.0 111.493 -175.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 26.8 m -108.78 131.51 54.89 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 176.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.529 ' HB2' ' HD3' ' A' ' 68' ' ' PRO 0.374 34.3 m 36.68 -89.95 0.0 OUTLIER Pre-proline 0 CA--C 1.578 2.054 0 N-CA-C 117.494 2.405 . . . . 0.0 117.494 176.952 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.529 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 41.2 Cg_exo -58.5 -46.64 23.07 Favored 'Trans proline' 0 C--N 1.404 3.468 0 CA-C-N 122.738 2.014 . . . . 0.0 111.035 179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.38 -37.61 87.93 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.027 -179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -69.06 -41.38 77.67 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-N 114.848 -1.069 . . . . 0.0 110.621 -178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -61.37 -35.95 78.9 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.889 0.376 . . . . 0.0 110.827 177.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -69.02 -47.06 66.39 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.331 179.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -70.37 -37.47 74.56 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.295 0.569 . . . . 0.0 111.331 -179.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.5 tp -73.84 -21.15 60.22 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.25 -48.18 66.24 Favored Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 111.099 -0.801 . . . . 0.0 111.099 175.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 23.3 ptt? -68.49 -30.51 69.36 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.961 0.41 . . . . 0.0 110.537 177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -61.91 -50.22 73.03 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 28.3 t -60.1 -38.68 83.67 Favored 'General case' 0 N--CA 1.44 -0.928 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.307 179.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.4 -46.72 85.13 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.97 0.414 . . . . 0.0 110.741 178.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.48 -32.15 72.78 Favored 'General case' 0 C--O 1.248 0.978 0 CA-C-O 120.934 0.397 . . . . 0.0 110.996 179.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.33 -49.88 51.62 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.54 -28.73 70.06 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.341 0.591 . . . . 0.0 110.874 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 40.9 t -72.27 -16.57 61.91 Favored 'General case' 0 CA--C 1.552 1.029 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.687 177.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 84.67 -11.77 58.34 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-O 121.386 0.437 . . . . 0.0 112.253 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -72.5 -23.72 61.06 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -176.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 38.7 tp -98.33 7.45 46.19 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-O 121.743 0.783 . . . . 0.0 109.1 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -68.15 -66.38 2.34 Favored Glycine 0 N--CA 1.443 -0.869 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.093 -177.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -56.04 -26.6 60.16 Favored 'Trans proline' 0 C--N 1.363 1.335 0 C-N-CA 123.212 2.608 . . . . 0.0 112.364 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.701 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 8.8 mp -66.53 -18.81 65.57 Favored 'General case' 0 C--O 1.211 -0.962 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.449 -178.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.426 ' HB2' HG23 ' A' ' 100' ' ' VAL . 23.7 mmt -75.77 -20.16 58.47 Favored 'General case' 0 C--N 1.309 -1.154 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.107 179.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 13.4 t -75.61 -21.71 57.54 Favored 'General case' 0 N--CA 1.436 -1.165 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.38 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.701 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 26.3 pt20 -78.69 -15.18 58.79 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.215 0.531 . . . . 0.0 110.294 -178.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.572 ' HB2' HD13 ' A' ' 95' ' ' LEU . 44.0 m-85 -95.83 -3.3 45.8 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.941 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 70.09 40.12 72.62 Favored Glycine 0 C--O 1.244 0.741 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 93' ' ' PHE . 2.2 mp -78.33 158.42 76.69 Favored Pre-proline 0 C--N 1.306 -1.304 0 CA-C-N 115.322 -0.439 . . . . 0.0 111.259 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.454 ' CG ' ' HB2' ' A' ' 118' ' ' ASN . 73.6 Cg_exo -50.12 139.18 35.28 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 123.206 2.604 . . . . 0.0 111.586 178.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.45 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.78 -34.23 72.74 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.976 0.417 . . . . 0.0 112.06 -177.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.49 ' HG2' ' HB1' ' A' ' 114' ' ' ALA . 1.2 pm0 -73.89 -36.66 64.79 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.613 178.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.87 -47.6 68.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.978 177.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.45 HG12 ' HA ' ' A' ' 97' ' ' ALA . 7.7 p -63.67 -36.54 76.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.838 179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.7 tp10 -61.24 -46.82 88.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 175.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.0 -40.95 86.44 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 178.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -65.48 -37.24 86.24 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.288 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -69.65 -39.71 76.93 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.04 177.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.483 ' HA ' ' HE2' ' A' ' 105' ' ' LYS . 10.4 mmpt? -74.54 -23.95 58.87 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.034 0.445 . . . . 0.0 110.152 179.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 93.95 24.5 19.87 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.994 176.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -101.94 111.21 23.4 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.567 -178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.83 -22.83 16.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.976 -175.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -78.2 -48.39 15.95 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-O 121.233 0.539 . . . . 0.0 109.703 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.77 95.75 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.21 -0.904 . . . . 0.0 109.659 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.582 ' O ' ' HB2' ' A' ' 115' ' ' MET . 81.6 t80 -61.27 -52.3 65.32 Favored 'General case' 0 C--O 1.211 -0.945 0 O-C-N 123.636 0.585 . . . . 0.0 109.821 177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 116' ' ' GLN . . . -54.98 -45.62 75.01 Favored 'General case' 0 C--O 1.236 0.379 0 O-C-N 123.829 0.706 . . . . 0.0 111.822 -177.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.406 ' HA ' HE21 ' A' ' 116' ' ' GLN . 30.7 ttpt -65.65 -57.05 9.01 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 121.446 0.641 . . . . 0.0 109.886 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.49 ' HB1' ' HG2' ' A' ' 98' ' ' GLU . . . -62.65 -35.22 78.94 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 114.98 -1.009 . . . . 0.0 112.758 -172.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.582 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.94 -58.76 6.24 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.611 0.764 . . . . 0.0 109.698 -178.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.462 ' HG3' ' O ' ' A' ' 112' ' ' ALA 0.265 4.1 pp0? -70.12 -16.39 63.11 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -80.16 -24.29 40.51 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 176.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.454 ' HB2' ' CG ' ' A' ' 96' ' ' PRO . 41.7 m-80 -128.79 16.68 6.33 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.697 -175.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -70.24 -48.17 58.12 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.048 0.451 . . . . 0.0 110.853 -177.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 53.5 tptt -114.89 97.96 48.87 Favored Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 -179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -93.29 21.91 0.61 Allowed 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.53 2.153 . . . . 0.0 111.737 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -104.52 119.58 39.3 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.739 -176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.505 ' HA ' HE21 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -96.47 -35.06 11.27 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.549 172.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 67.2 mttm 61.97 18.93 10.33 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.039 1.336 . . . . 0.0 111.087 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -102.69 -27.29 12.8 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -173.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 100.5 -150.76 18.91 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -178.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -155.41 103.86 2.35 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 117.38 0.59 . . . . 0.0 111.133 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 95.0 m -90.29 126.66 35.92 Favored 'General case' 0 C--N 1.31 -1.118 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 176.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.44 ' HD2' ' N ' ' A' ' 129' ' ' LYS . 3.7 mptp? -73.71 -63.73 1.14 Allowed 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.81 -177.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -117.32 -88.21 0.6 Allowed 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 119.949 -0.7 . . . . 0.0 110.571 179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -156.63 170.58 22.08 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -140.91 14.81 2.28 Favored 'General case' 0 C--N 1.305 -1.345 0 O-C-N 124.013 0.82 . . . . 0.0 109.755 174.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -108.3 141.32 40.26 Favored 'General case' 0 N--CA 1.425 -1.693 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -77.47 135.25 38.24 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.111 0.481 . . . . 0.0 110.85 -177.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -107.3 -179.38 3.91 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 175.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.84 -22.13 37.17 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.337 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 38.4 t70 55.99 67.61 0.98 Allowed 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.21 -1.359 . . . . 0.0 110.154 -177.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 88.3 mtp 65.43 -78.11 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 113.605 -1.634 . . . . 0.0 112.321 -176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 12.4 p 51.13 35.43 13.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 122.519 1.152 . . . . 0.0 111.021 -174.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -106.66 -54.36 2.48 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 113.954 -1.475 . . . . 0.0 108.388 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 25.5 t70 . . . . . 0 C--N 1.301 -1.512 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.841 -178.518 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.437 -1.077 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 p-10 -90.14 131.18 36.12 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 120.926 0.393 . . . . 0.0 110.688 -177.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.4 93.91 2.44 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.076 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 60.3 mt -82.12 92.36 2.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.375 0 N-CA-C 107.845 -1.168 . . . . 0.0 107.845 177.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.2 tt -93.86 127.13 39.45 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -64.33 105.39 0.91 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.551 -0.536 . . . . 0.0 109.551 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.0 m -91.35 45.51 1.24 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 122.853 1.311 . . . . 0.0 111.0 -173.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 7.8 tmm? -162.76 95.11 0.88 Allowed 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 102.751 -3.055 . . . . 0.0 102.751 173.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -150.16 177.35 9.99 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.486 -171.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.7 m -112.62 101.2 52.32 Favored Pre-proline 0 N--CA 1.433 -1.283 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 173.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -55.94 -40.8 82.86 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.947 2.431 . . . . 0.0 112.854 -176.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.09 60.51 3.4 Favored 'General case' 0 C--O 1.247 0.935 0 O-C-N 124.261 0.976 . . . . 0.0 109.669 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.43 ' HA2' ' HD3' ' A' ' 14' ' ' PRO . . . -82.31 136.09 15.09 Favored Glycine 0 N--CA 1.426 -1.971 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.953 -178.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD3' ' HA2' ' A' ' 13' ' ' GLY . 25.2 Cg_exo -68.38 27.83 0.14 Allowed 'Trans proline' 0 CA--C 1.554 1.491 0 C-N-CA 124.046 3.164 . . . . 0.0 114.266 179.529 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.485 ' HB2' HE22 ' A' ' 71' ' ' GLN . . . -73.49 153.19 40.43 Favored 'General case' 0 C--N 1.316 -0.887 0 C-N-CA 123.357 0.663 . . . . 0.0 109.344 177.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 158.87 -160.29 31.0 Favored Glycine 0 N--CA 1.426 -2.009 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.396 -179.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -82.25 51.55 4.51 Favored Glycine 0 C--N 1.31 -0.891 0 N-CA-C 112.425 -0.27 . . . . 0.0 112.425 -177.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -89.8 130.0 36.11 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 177.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -75.96 -37.88 58.14 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 119.57 -0.852 . . . . 0.0 109.171 179.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.5 t -92.06 73.4 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 172.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.481 ' O ' HG12 ' A' ' 25' ' ' VAL . 17.2 t70 -83.7 109.19 17.28 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 114.213 -1.358 . . . . 0.0 107.806 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.452 HD13 HD23 ' A' ' 74' ' ' LEU . 1.1 pp -64.25 -33.4 75.74 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 115.058 1.503 . . . . 0.0 115.058 -174.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.98 -28.19 60.46 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -175.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 p -83.34 -31.59 26.72 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.481 HG12 ' O ' ' A' ' 21' ' ' ASP . 5.7 p -80.11 -44.97 22.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 120.989 0.424 . . . . 0.0 111.424 178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.0 mt -110.09 109.33 19.83 Favored 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . 0.406 ' HB ' ' OE1' ' A' ' 29' ' ' GLU . 19.4 p -90.02 159.74 42.0 Favored Pre-proline 0 C--N 1.298 -1.637 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.626 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.9 -30.11 75.84 Favored 'Trans proline' 0 C--N 1.363 1.334 0 C-N-CA 123.211 2.607 . . . . 0.0 113.071 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' OE1' ' HB ' ' A' ' 27' ' ' THR . 3.0 pm0 -70.55 -43.11 70.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.533 0.198 . . . . 0.0 111.533 176.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.06 -37.71 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 CA-C-O 121.651 0.739 . . . . 0.0 109.582 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.512 ' HE2' ' HA ' ' A' ' 31' ' ' MET . 29.1 mmt -78.98 -14.27 59.3 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.181 -179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -59.38 -57.3 27.98 Favored Pre-proline 0 CA--C 1.547 0.853 0 N-CA-C 114.445 1.276 . . . . 0.0 114.445 -175.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -68.22 -24.76 37.56 Favored 'Trans proline' 0 C--N 1.369 1.609 0 CA-C-N 120.741 1.3 . . . . 0.0 112.069 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 72.4 mt -75.15 -56.34 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.092 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.537 -178.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.424 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.1 mp -70.51 -14.92 62.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -176.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.64 -11.22 59.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.245 0.545 . . . . 0.0 110.917 177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.529 ' O ' HG22 ' A' ' 40' ' ' VAL . 46.4 t-20 -81.3 125.04 29.87 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -179.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.14 -27.89 69.26 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.831 -0.622 . . . . 0.0 112.472 -176.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 9.2 t70 -77.43 -28.44 52.56 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.866 -177.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.2 m -74.26 -35.72 41.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 176.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' HD13 ' A' ' 54' ' ' LEU . 80.5 mt-30 -64.05 -30.64 71.69 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.752 176.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.517 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 22.2 tp10 -60.59 -44.25 96.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.537 0.735 . . . . 0.0 109.522 175.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -75.98 -28.47 57.85 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.428 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.9 mp -82.37 -17.52 45.29 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 21.6 mt -46.24 -52.74 26.54 Favored Pre-proline 0 N--CA 1.484 1.261 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -64.7 -16.05 53.3 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 121.923 1.748 . . . . 0.0 112.809 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.424 ' HB2' ' HB2' ' A' ' 76' ' ' MET . 55.9 m-85 -110.79 -1.94 16.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.907 -174.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.595 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 2.7 tt -57.9 118.91 29.72 Favored Pre-proline 0 C--O 1.241 0.653 0 C-N-CA 123.955 0.902 . . . . 0.0 109.215 -175.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -58.24 129.16 31.51 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.555 2.17 . . . . 0.0 111.792 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -59.33 116.36 3.87 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.514 -179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.62 -11.58 35.63 Favored Glycine 0 N--CA 1.439 -1.162 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.416 -178.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -93.64 170.72 9.37 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.414 ' O ' ' HD3' ' A' ' 55' ' ' PRO . 19.5 m -130.22 166.23 20.73 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -178.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.472 HD13 ' HB3' ' A' ' 41' ' ' GLN . 96.6 mt -101.52 104.75 36.22 Favored Pre-proline 0 C--N 1.312 -1.058 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 177.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.414 ' HD3' ' O ' ' A' ' 53' ' ' SER . 24.2 Cg_exo -64.94 127.9 19.59 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 C-N-CA 121.73 1.62 . . . . 0.0 109.674 176.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -80.21 -52.47 7.7 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 121.747 0.784 . . . . 0.0 109.965 -174.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.449 ' OG1' ' HG3' ' A' ' 60' ' ' GLU . 33.2 p -94.81 156.48 16.35 Favored 'General case' 0 N--CA 1.41 -2.457 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.83 -179.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.562 ' HB1' ' HB1' ' A' ' 32' ' ' ALA . . . -61.9 -25.09 67.35 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.453 179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -62.1 -51.5 67.65 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.449 ' HG3' ' OG1' ' A' ' 57' ' ' THR . 32.9 mt-10 -65.43 -30.45 71.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.964 -1.017 . . . . 0.0 110.713 -178.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.3 mt -62.11 -38.75 81.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 176.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -75.47 -23.17 56.82 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.923 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -70.95 -61.74 1.65 Allowed 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.483 0.658 . . . . 0.0 110.351 178.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 17.8 m -83.09 -44.34 15.25 Favored 'General case' 0 N--CA 1.431 -1.377 0 CA-C-N 115.571 -0.741 . . . . 0.0 112.198 -172.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.1 mt -96.63 76.11 2.83 Favored 'General case' 0 C--N 1.3 -1.564 0 CA-C-O 121.624 0.726 . . . . 0.0 111.816 -170.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.3 p -92.05 -67.38 0.86 Allowed 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.925 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.524 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 43.5 m -134.47 -66.4 0.02 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.524 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 21.9 Cg_exo -66.37 -50.96 1.19 Allowed 'Trans proline' 0 C--N 1.377 2.035 0 CA-C-N 121.556 1.591 . . . . 0.0 111.419 -178.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.79 -34.97 75.3 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.558 0.694 . . . . 0.0 109.388 177.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -64.27 -40.32 95.75 Favored 'General case' 0 C--O 1.205 -1.26 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.883 -178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.485 HE22 ' HB2' ' A' ' 15' ' ' ALA . 99.3 mt-30 -66.56 -28.55 68.62 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.362 178.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -73.47 -45.96 51.05 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 177.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -68.81 -38.97 80.29 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.046 179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 HD13 ' A' ' 22' ' ' LEU . 22.7 tp -73.23 -20.51 60.84 Favored 'General case' 0 C--N 1.305 -1.335 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.7 -42.9 61.21 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 174.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.595 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 26.5 ptt? -69.87 -30.56 68.05 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -62.78 -51.04 68.64 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.377 -0.971 . . . . 0.0 108.377 174.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.9 t -58.13 -44.51 87.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.855 0.862 . . . . 0.0 110.34 178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.64 -42.46 98.14 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.2 -31.71 67.95 Favored 'General case' 0 C--O 1.253 1.274 0 CA-C-O 121.436 0.636 . . . . 0.0 110.66 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.504 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.5 tt -69.39 -50.19 48.34 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 178.1 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -64.1 -21.5 66.56 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.491 0.663 . . . . 0.0 111.271 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 42.0 t -74.23 -33.15 63.27 Favored 'General case' 0 N--CA 1.435 -1.224 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.658 175.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 95.67 2.12 61.61 Favored Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.358 -178.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -84.67 -23.18 29.55 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.103 0.477 . . . . 0.0 110.837 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 29.5 tp -92.94 2.0 57.01 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-O 121.523 0.678 . . . . 0.0 110.215 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -61.85 -63.05 5.1 Favored Glycine 0 CA--C 1.527 0.798 0 CA-C-N 115.28 -0.873 . . . . 0.0 114.007 -178.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -50.74 -26.75 18.2 Favored 'Trans proline' 0 C--N 1.368 1.594 0 C-N-CA 124.038 3.159 . . . . 0.0 114.089 -178.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.496 HD11 ' OD1' ' A' ' 39' ' ' ASP . 3.8 mm? -66.75 -31.91 72.87 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 122.836 0.454 . . . . 0.0 112.217 -178.017 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.0 mmt -69.59 -24.08 63.63 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-O 121.287 0.565 . . . . 0.0 111.884 -175.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 54.1 t -71.32 -18.17 62.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.079 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.8 mt-30 -92.54 -0.52 57.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.134 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.493 ' HB2' HD13 ' A' ' 95' ' ' LEU . 53.6 m-85 -111.79 2.16 16.98 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.232 0.539 . . . . 0.0 110.665 178.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 67.34 36.71 89.76 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.981 -179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 93' ' ' PHE . 4.5 mp -78.64 156.39 77.93 Favored Pre-proline 0 C--N 1.306 -1.301 0 CA-C-N 115.533 -0.333 . . . . 0.0 111.181 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -52.47 155.91 9.2 Favored 'Trans proline' 0 C--N 1.359 1.122 0 C-N-CA 123.596 2.864 . . . . 0.0 112.819 179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -63.52 -35.29 79.99 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.823 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -67.45 -39.77 85.37 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.544 178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.05 -48.8 61.91 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.928 -177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 13.5 p -65.36 -36.45 77.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 120.221 -0.591 . . . . 0.0 110.56 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.33 -51.66 68.49 Favored 'General case' 0 C--N 1.344 0.354 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.0 -41.09 97.67 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.635 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -67.3 -41.2 85.77 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 120.747 0.308 . . . . 0.0 111.327 -179.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.23 -45.29 92.3 Favored 'General case' 0 CA--C 1.505 -0.755 0 CA-C-O 121.457 0.646 . . . . 0.0 110.173 177.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -79.21 -19.57 50.46 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.648 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.504 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 93.16 29.5 10.27 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 120.706 -0.759 . . . . 0.0 113.528 172.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -107.95 115.33 29.94 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 120.377 -0.529 . . . . 0.0 110.032 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 20.2 m -77.32 -27.74 16.02 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.982 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -80.19 -35.96 35.6 Favored 'General case' 0 CA--C 1.502 -0.896 0 C-N-CA 119.511 -0.875 . . . . 0.0 110.474 -175.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.8 -38.73 89.75 Favored 'General case' 0 N--CA 1.439 -0.982 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.33 175.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.485 ' O ' ' HG2' ' A' ' 115' ' ' MET . 82.8 t80 -64.95 -50.09 67.78 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.298 -0.864 . . . . 0.0 109.2 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -54.03 -47.43 71.56 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.991 179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.548 ' HA ' ' NE2' ' A' ' 116' ' ' GLN . 57.7 tttm -62.99 -54.43 38.41 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.395 179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -54.86 -39.12 68.3 Favored 'General case' 0 C--O 1.248 1.011 0 C-N-CA 122.833 0.453 . . . . 0.0 111.744 -178.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.485 ' HG2' ' O ' ' A' ' 111' ' ' PHE . 98.0 mmm -63.53 -54.72 31.83 Favored 'General case' 0 C--O 1.21 -0.993 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.019 179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.548 ' NE2' ' HA ' ' A' ' 113' ' ' LYS 0.333 3.0 pp0? -76.8 -8.93 58.25 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 118.525 -1.27 . . . . 0.0 114.254 179.323 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.87 -19.72 47.61 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 116.71 -0.223 . . . . 0.0 110.596 174.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -130.88 -45.87 1.04 Allowed 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -100.29 15.13 28.65 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -170.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 116' ' ' GLN . 63.0 tttm -87.09 116.1 64.93 Favored Pre-proline 0 C--O 1.242 0.697 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 176.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 120' ' ' LYS . 2.7 Cg_exo -73.77 75.91 3.0 Favored 'Trans proline' 0 N--CA 1.459 -0.549 0 C-N-CA 122.522 2.148 . . . . 0.0 113.007 -174.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -91.11 98.54 11.81 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.945 -179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 65.59 -73.63 0.06 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.643 1.577 . . . . 0.0 112.13 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . 0.37 32.2 mttp 47.84 65.43 1.3 Allowed 'General case' 0 CA--C 1.493 -1.25 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 -175.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.91 71.57 0.42 Allowed 'General case' 0 N--CA 1.421 -1.912 0 N-CA-C 104.805 -2.294 . . . . 0.0 104.805 175.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -137.62 73.88 0.42 Allowed Glycine 0 N--CA 1.42 -2.372 0 N-CA-C 107.303 -2.319 . . . . 0.0 107.303 179.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -78.55 178.89 7.43 Favored 'General case' 0 C--N 1.29 -1.988 0 CA-C-N 114.557 -0.821 . . . . 0.0 109.369 -174.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 15.1 m -97.13 111.79 23.87 Favored 'General case' 0 N--CA 1.427 -1.58 0 O-C-N 121.792 -0.567 . . . . 0.0 110.92 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 129' ' ' LYS . 0.1 OUTLIER -123.24 83.36 2.12 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 122.031 0.92 . . . . 0.0 110.028 176.286 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -93.12 -23.24 18.67 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.475 -1.238 . . . . 0.0 111.005 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 27.7 ttpp -84.58 111.5 19.58 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 12.7 mmmm -138.06 178.09 7.39 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 -174.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -66.5 -30.87 71.3 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 170.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -81.38 90.72 6.19 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 172.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -117.89 -54.15 2.35 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.795 -175.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -102.88 145.95 29.04 Favored 'General case' 0 C--N 1.288 -2.101 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.517 -174.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -100.56 124.33 45.98 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.51 -1.293 . . . . 0.0 107.51 173.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 13.9 tpt -78.63 80.46 5.0 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.904 0.859 . . . . 0.0 110.107 179.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 2.1 m -77.45 -29.66 52.9 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 114.935 -1.03 . . . . 0.0 109.823 -178.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 7.3 mp -58.98 -53.44 58.41 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.965 -177.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 CA--C 1.487 -1.461 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.821 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.243 0.719 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.6 p-10 -121.12 141.69 50.56 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.843 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -106.2 97.02 6.88 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 -178.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 1.7 pt -115.68 -11.42 11.97 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.146 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.94 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.7 tt 69.58 -64.87 0.33 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.053 1.341 . . . . 0.0 110.141 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 174.4 -33.05 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 127.05 2.14 . . . . 0.0 105.558 -177.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 m 72.82 -56.12 0.66 Allowed 'General case' 0 C--N 1.351 0.673 0 CA-C-N 113.749 -1.569 . . . . 0.0 111.567 176.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.532 ' SD ' ' HG3' ' A' ' 46' ' ' PRO . 20.4 ptm -130.87 103.19 6.42 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 121.6 0.714 . . . . 0.0 110.398 -178.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -80.69 104.83 11.48 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.163 178.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -138.29 134.99 17.93 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.696 -179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -66.2 -45.89 5.06 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 121.98 1.787 . . . . 0.0 109.157 170.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.44 -167.05 0.13 Allowed 'General case' 0 C--O 1.245 0.844 0 C-N-CA 124.947 1.299 . . . . 0.0 112.902 175.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -139.57 76.57 0.33 Allowed Glycine 0 N--CA 1.435 -1.389 0 N-CA-C 109.406 -1.478 . . . . 0.0 109.406 174.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.8 -46.66 10.49 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 123.062 2.508 . . . . 0.0 114.198 -177.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -73.76 122.22 22.06 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.867 0.365 . . . . 0.0 110.775 -177.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -158.3 110.78 0.46 Allowed Glycine 0 N--CA 1.429 -1.816 0 N-CA-C 109.907 -1.277 . . . . 0.0 109.907 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 70.87 -114.52 5.35 Favored Glycine 0 C--N 1.312 -0.785 0 C-N-CA 121.073 -0.584 . . . . 0.0 112.006 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 70.58 103.23 0.06 Allowed 'General case' 0 C--O 1.246 0.871 0 C-N-CA 125.41 1.484 . . . . 0.0 113.24 178.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -108.53 159.07 16.99 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 175.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.5 t 69.47 125.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 O-C-N 124.334 1.021 . . . . 0.0 110.848 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.402 ' O ' HG12 ' A' ' 25' ' ' VAL . 13.0 t70 -70.55 104.35 2.76 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.258 0.551 . . . . 0.0 109.861 -176.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 23' ' ' ALA . 1.1 pp -53.26 -36.29 60.97 Favored 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 -177.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 22' ' ' LEU . . . -81.04 -23.29 38.68 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.221 0.534 . . . . 0.0 111.217 -175.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 32.9 t -84.48 -18.17 36.71 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.704 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 116' ' ' GLN . 7.4 p -105.63 -43.26 7.42 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 CA-C-O 120.904 0.383 . . . . 0.0 111.89 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -101.82 117.8 35.61 Favored 'General case' 0 N--CA 1.433 -1.287 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 5.1 p -97.88 156.06 36.4 Favored Pre-proline 0 C--N 1.297 -1.675 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.552 -179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -50.48 -31.89 32.55 Favored 'Trans proline' 0 C--N 1.367 1.55 0 C-N-CA 123.772 2.981 . . . . 0.0 113.547 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -65.24 -36.44 84.13 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.551 0.74 . . . . 0.0 111.912 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 56.5 mt -79.84 -34.31 15.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 121.895 0.855 . . . . 0.0 109.376 -177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 70.1 mmm -84.21 -11.09 57.1 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.727 -174.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -55.6 -56.24 31.75 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.63 -21.87 28.86 Favored 'Trans proline' 0 C--N 1.37 1.665 0 CA-C-N 120.628 1.26 . . . . 0.0 112.637 -178.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.37 -57.95 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.157 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.7 mp -69.83 -13.38 62.24 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.39 -5.55 50.13 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.463 0.649 . . . . 0.0 110.485 177.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.509 ' OD1' ' HB3' ' A' ' 39' ' ' ASP . 26.1 t-20 -85.81 117.73 24.86 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.485 ' O ' ' HG3' ' A' ' 42' ' ' GLU . . . -61.11 -34.38 74.87 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.125 0.488 . . . . 0.0 111.652 -177.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.509 ' HB3' ' OD1' ' A' ' 37' ' ' ASN . 33.1 t70 -64.18 -39.83 94.83 Favored 'General case' 0 C--O 1.273 2.312 0 C-N-CA 123.803 0.841 . . . . 0.0 111.234 -178.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' O ' ' A' ' 37' ' ' ASN . 13.2 m -70.09 -34.96 61.63 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 O-C-N 121.74 -0.6 . . . . 0.0 109.985 176.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.443 ' HB3' HD13 ' A' ' 54' ' ' LEU . 77.4 mt-30 -61.57 -31.88 71.95 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.869 179.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 38' ' ' ALA . 47.0 mt-10 -67.62 -30.03 69.5 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.174 177.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -75.29 -24.45 57.51 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 120.922 0.392 . . . . 0.0 111.498 173.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.411 HD13 ' O ' ' A' ' 40' ' ' VAL . 9.0 mp -84.88 -17.8 36.76 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.185 179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 mt -49.94 -45.71 80.95 Favored Pre-proline 0 N--CA 1.48 1.035 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.532 ' HG3' ' SD ' ' A' ' 8' ' ' MET . 22.6 Cg_exo -65.89 -18.5 57.69 Favored 'Trans proline' 0 C--N 1.37 1.658 0 CA-C-N 120.987 1.388 . . . . 0.0 111.902 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.5 m-85 -112.46 4.45 17.48 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.291 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.423 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 65.3 tp -57.42 114.05 7.48 Favored Pre-proline 0 C--O 1.25 1.089 0 O-C-N 124.315 1.009 . . . . 0.0 109.807 179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.498 ' HG2' ' HG2' ' A' ' 72' ' ' GLN . 37.9 Cg_exo -61.97 171.46 4.91 Favored 'Trans proline' 0 C--O 1.252 1.188 0 C-N-CA 123.678 2.918 . . . . 0.0 114.456 -177.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 5.1 p -70.14 116.28 10.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 113.836 -1.529 . . . . 0.0 113.184 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 75.06 10.73 84.18 Favored Glycine 0 C--N 1.332 0.332 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.89 177.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -97.92 167.96 10.59 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.6 m -135.21 165.49 25.3 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 121.297 0.57 . . . . 0.0 111.522 -176.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.443 HD13 ' HB3' ' A' ' 41' ' ' GLN . 66.0 mt -100.09 122.72 49.51 Favored Pre-proline 0 C--N 1.3 -1.566 0 C-N-CA 124.242 1.017 . . . . 0.0 108.883 178.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.25 135.55 31.97 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.264 1.976 . . . . 0.0 110.752 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 -74.77 -56.12 5.12 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -173.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.595 ' OG1' ' HG2' ' A' ' 60' ' ' GLU . 72.8 p -106.25 169.53 8.45 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.111 -176.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -61.22 -34.78 75.67 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-O 120.896 0.379 . . . . 0.0 110.32 177.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.41 -49.09 78.29 Favored 'General case' 0 CA--C 1.498 -1.058 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.401 176.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.595 ' HG2' ' OG1' ' A' ' 57' ' ' THR . 34.8 mm-40 -58.61 -39.81 81.51 Favored 'General case' 0 C--O 1.21 -0.995 0 O-C-N 123.354 0.409 . . . . 0.0 110.186 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 57' ' ' THR . 85.5 mt -58.41 -42.98 85.57 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.693 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.202 179.113 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 25.7 mm-40 -68.4 -29.83 68.61 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 120.964 0.412 . . . . 0.0 110.804 -178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -81.39 -48.81 11.44 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.081 -178.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 34.8 m -70.98 -42.28 69.9 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.504 -176.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.443 HD12 HG23 ' A' ' 61' ' ' ILE . 30.4 mt -102.03 86.76 2.94 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.173 -174.115 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 20.1 p -86.26 -66.29 0.92 Allowed 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 175.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.477 ' HB2' ' HD3' ' A' ' 68' ' ' PRO . 42.7 m -147.74 -56.66 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.449 0 CA-C-O 118.562 -0.732 . . . . 0.0 111.691 175.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.477 ' HD3' ' HB2' ' A' ' 67' ' ' SER . 54.0 Cg_exo -57.09 -57.24 1.39 Allowed 'Trans proline' 0 C--N 1.388 2.655 0 C-N-CA 121.946 1.764 . . . . 0.0 112.599 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -72.77 -20.35 61.19 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-O 121.14 0.495 . . . . 0.0 110.551 -179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -67.15 -44.86 78.71 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.635 177.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -62.4 -38.91 91.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.973 0.416 . . . . 0.0 110.225 176.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.498 ' HG2' ' HG2' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -57.83 -52.96 63.33 Favored 'General case' 0 C--O 1.25 1.084 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.413 176.012 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.428 ' HA ' ' HE2' ' A' ' 76' ' ' MET . . . -73.95 -36.59 64.64 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 121.194 0.521 . . . . 0.0 112.295 -175.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.4 tp -73.66 -24.97 60.05 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.46 -44.49 83.62 Favored Glycine 0 N--CA 1.444 -0.805 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 176.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.46 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 23.6 ptt? -69.67 -30.43 68.1 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.494 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.0 t80 -61.9 -52.99 61.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.096 174.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 42.4 t -59.32 -42.94 92.57 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.333 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -58.21 -47.72 82.6 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.697 0.399 . . . . 0.0 111.456 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.46 -33.07 74.87 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 121.343 0.592 . . . . 0.0 110.765 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.406 HD22 HG12 ' A' ' 108' ' ' VAL . 6.0 tt -68.24 -50.5 53.55 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.763 177.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.01 69.01 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 123.418 0.687 . . . . 0.0 111.294 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 49.4 m -73.14 -22.27 60.55 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.433 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 94.65 -12.47 68.68 Favored Glycine 0 C--O 1.238 0.385 0 N-CA-C 111.875 -0.49 . . . . 0.0 111.875 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.26 -38.76 92.44 Favored 'General case' 0 CA--C 1.511 -0.542 0 C-N-CA 124.096 0.958 . . . . 0.0 111.424 -177.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.9 tp -90.67 1.82 56.48 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.588 -175.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -60.45 -62.14 6.32 Favored Glycine 0 CA--C 1.526 0.748 0 CA-C-N 115.424 -0.807 . . . . 0.0 114.599 -178.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -56.64 -25.52 60.13 Favored 'Trans proline' 0 C--N 1.361 1.202 0 C-N-CA 123.182 2.588 . . . . 0.0 113.279 -178.174 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.674 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 7.8 mp -72.69 -15.91 61.69 Favored 'General case' 0 C--O 1.21 -0.998 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -175.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 23.5 mmt -75.3 -19.64 59.55 Favored 'General case' 0 C--N 1.312 -1.024 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.889 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 45.0 t -73.33 -28.83 62.29 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.77 -179.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.674 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 11.5 pt20 -81.0 0.19 36.76 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.296 0.57 . . . . 0.0 111.285 -177.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -108.0 -8.56 15.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.15 0.5 . . . . 0.0 109.985 174.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.1 31.84 54.19 Favored Glycine 0 N--CA 1.438 -1.218 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.471 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 1.7 mp -72.11 154.24 92.37 Favored Pre-proline 0 C--N 1.308 -1.221 0 CA-C-N 115.403 -0.398 . . . . 0.0 111.121 179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.472 ' HG3' ' HB2' ' A' ' 118' ' ' ASN . 2.2 Cg_endo -47.54 145.09 9.42 Favored 'Trans proline' 0 C--O 1.244 0.807 0 C-N-CA 123.968 3.112 . . . . 0.0 112.469 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -59.85 -36.82 77.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.369 -177.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -73.42 -31.21 63.72 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.649 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.22 -48.41 43.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.427 177.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.409 HG12 ' HA ' ' A' ' 97' ' ' ALA . 9.5 p -62.84 -36.41 75.39 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.591 -0.443 . . . . 0.0 110.225 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.547 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 27.3 tt0 -56.72 -54.13 49.79 Favored 'General case' 0 C--O 1.226 -0.183 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.946 174.014 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.71 -39.26 84.05 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.388 -177.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.13 -31.71 73.01 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.236 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -79.62 -34.45 40.59 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.243 177.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 75.4 mmtt -73.44 -24.04 60.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.413 -179.21 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 85.77 25.27 38.92 Favored Glycine 0 N--CA 1.434 -1.466 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 -176.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -100.45 104.84 16.26 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 -177.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.406 HG12 HD22 ' A' ' 81' ' ' LEU . 27.4 m -76.86 -30.31 18.27 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -175.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -75.58 -37.67 59.69 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 120.261 -0.576 . . . . 0.0 111.005 -178.126 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.19 -35.32 80.15 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.256 177.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -68.58 -48.27 64.65 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -55.37 -49.77 71.41 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.261 -0.882 . . . . 0.0 111.84 -179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -63.5 -43.7 96.49 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.041 0.448 . . . . 0.0 110.245 -178.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.46 -39.64 95.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.04 -179.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 97.7 mmm -69.51 -40.42 76.97 Favored 'General case' 0 C--N 1.31 -1.148 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -178.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.474 ' HG2' HG23 ' A' ' 25' ' ' VAL 0.257 0.8 OUTLIER -74.24 -22.73 59.21 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 119.398 -0.921 . . . . 0.0 113.055 179.617 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -83.94 -39.06 20.24 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.863 0.363 . . . . 0.0 111.577 176.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.472 ' HB2' ' HG3' ' A' ' 96' ' ' PRO . 46.6 m-80 -99.04 -46.72 5.49 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -174.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -83.93 7.62 17.66 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.423 0.63 . . . . 0.0 111.778 -172.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -111.76 92.76 18.16 Favored Pre-proline 0 C--N 1.293 -1.873 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.89 -43.89 14.73 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 122.784 2.323 . . . . 0.0 114.083 -173.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 68.21 171.27 0.28 Allowed 'General case' 0 C--O 1.243 0.724 0 C-N-CA 124.359 1.064 . . . . 0.0 111.992 -177.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -146.54 -56.7 0.27 Allowed 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.25 -177.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt 40.25 74.96 0.09 Allowed 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.45 1.5 . . . . 0.0 114.582 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -79.09 0.12 29.27 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.241 -179.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -73.82 57.85 2.18 Favored Glycine 0 N--CA 1.464 0.525 0 CA-C-O 121.698 0.61 . . . . 0.0 111.681 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -141.65 -65.75 0.42 Allowed 'General case' 0 C--N 1.285 -2.232 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 -177.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . 0.516 HG22 ' H ' ' A' ' 130' ' ' ASP . 9.1 m 67.96 149.58 0.06 Allowed 'General case' 0 CA--C 1.571 1.755 0 C-N-CA 124.234 1.014 . . . . 0.0 112.458 175.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -70.27 -23.24 62.85 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.738 0.78 . . . . 0.0 109.938 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . 0.516 ' H ' HG22 ' A' ' 128' ' ' THR . 9.5 m-20 -78.93 140.44 38.06 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.221 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 50.8 tptt 68.87 31.06 4.46 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 124.708 1.255 . . . . 0.0 108.576 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -124.49 -53.58 1.69 Allowed 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.15 -179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -97.43 -73.41 0.61 Allowed 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -172.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -82.93 102.26 11.58 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -166.16 82.81 0.29 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.22 -2.141 . . . . 0.0 105.22 173.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -93.56 110.38 21.98 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.31 -176.139 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -126.12 132.26 51.9 Favored 'General case' 0 C--N 1.295 -1.795 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 67.2 mtt -93.72 -42.19 9.28 Favored 'General case' 0 C--N 1.286 -2.186 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.579 -179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 50.4 m 53.23 40.35 31.13 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.931 0.769 . . . . 0.0 111.022 177.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 67.51 89.02 0.1 Allowed 'General case' 0 C--O 1.249 1.034 0 C-N-CA 124.526 1.131 . . . . 0.0 110.398 -175.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.301 -1.509 0 CA-C-N 115.119 -0.946 . . . . 0.0 109.286 -178.077 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -102.01 85.63 2.72 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.45 85.03 6.79 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -169.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.2 mp -108.84 -68.03 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.411 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 168.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.513 HD13 ' O ' ' A' ' 5' ' ' LEU . 2.9 tm? -117.43 -14.52 10.34 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -58.53 128.81 39.05 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.769 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.8 t -137.56 -170.55 2.78 Favored 'General case' 0 C--N 1.289 -2.029 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 -178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -82.34 -17.28 46.24 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-O 120.699 0.285 . . . . 0.0 111.101 -176.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -116.55 156.29 27.2 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.134 0.492 . . . . 0.0 111.412 -174.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.6 t -137.84 122.37 12.07 Favored Pre-proline 0 C--N 1.307 -1.251 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -64.18 -45.79 9.24 Favored 'Trans proline' 0 C--O 1.25 1.123 0 C-N-CA 122.588 2.192 . . . . 0.0 112.001 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.72 -162.59 0.27 Allowed 'General case' 0 C--O 1.249 1.038 0 O-C-N 124.054 0.846 . . . . 0.0 109.846 -178.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.18 -166.67 38.9 Favored Glycine 0 N--CA 1.425 -2.052 0 N-CA-C 110.341 -1.104 . . . . 0.0 110.341 178.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -55.62 139.32 82.77 Favored 'Trans proline' 0 C--O 1.239 0.561 0 C-N-CA 123.181 2.587 . . . . 0.0 111.26 178.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.78 109.2 2.79 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.529 -179.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -84.52 54.07 4.89 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 -178.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -108.93 124.3 7.3 Favored Glycine 0 N--CA 1.428 -1.844 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.62 161.03 35.74 Favored 'General case' 0 C--N 1.292 -1.891 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -177.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 18.4 mp0 -61.59 -43.32 99.07 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 123.275 0.63 . . . . 0.0 111.176 -176.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 48.1 t -84.54 80.62 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 N-CA-C 106.565 -1.642 . . . . 0.0 106.565 173.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.482 ' O ' HG12 ' A' ' 25' ' ' VAL . 21.5 t70 -56.85 119.79 6.82 Favored 'General case' 0 CA--C 1.494 -1.207 0 CA-C-N 114.129 -1.396 . . . . 0.0 112.49 -175.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.418 HD13 HD23 ' A' ' 74' ' ' LEU . 0.7 OUTLIER -50.89 -38.06 47.52 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 114.068 -1.423 . . . . 0.0 114.386 -178.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.74 -23.8 36.47 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 120.982 0.42 . . . . 0.0 111.978 -175.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 m -79.9 -28.71 39.81 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-O 121.158 0.504 . . . . 0.0 111.34 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 21' ' ' ASP . 3.0 p -97.8 -46.39 12.59 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.195 178.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 74.2 mt -100.67 97.8 8.42 Favored 'General case' 0 C--N 1.309 -1.172 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 7.5 p -89.89 158.8 44.21 Favored Pre-proline 0 C--N 1.303 -1.429 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.371 -175.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -56.09 -28.36 69.52 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 123.295 2.664 . . . . 0.0 112.798 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -66.88 -32.41 73.65 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 120.909 0.385 . . . . 0.0 110.916 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -83.01 -37.56 13.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.494 ' HB3' HD13 ' A' ' 35' ' ' LEU . 25.1 mmt -79.33 -5.31 54.21 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-N 114.749 -1.114 . . . . 0.0 113.006 -176.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.483 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -60.39 -57.74 24.41 Favored Pre-proline 0 C--N 1.314 -0.968 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -70.94 -21.59 27.8 Favored 'Trans proline' 0 C--N 1.376 1.974 0 C-N-CA 121.196 1.264 . . . . 0.0 112.034 -179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 68.7 mt -76.66 -56.67 7.58 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.56 -178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' ' 31' ' ' MET . 10.3 mp -71.46 -13.07 61.71 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -177.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.29 -5.06 50.91 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.162 0.506 . . . . 0.0 110.524 176.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.513 ' O ' HG22 ' A' ' 40' ' ' VAL . 25.9 t-20 -84.43 124.39 31.28 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 177.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.85 -27.69 67.74 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.663 ' O ' ' HD3' ' A' ' 43' ' ' ARG . 15.5 t70 -72.58 -42.91 64.06 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 37' ' ' ASN . 10.0 m -63.0 -35.32 71.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.516 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 76.3 mt-30 -60.88 -40.13 91.87 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.658 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -63.46 -35.78 81.56 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.779 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' A' ' 39' ' ' ASP . 1.6 mpt_? -74.0 -27.26 60.88 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.568 179.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.42 HD13 ' O ' ' A' ' 40' ' ' VAL . 10.4 mp -87.05 -24.93 24.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.248 -0.433 . . . . 0.0 112.133 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 65.3 mt -44.54 -48.78 26.79 Favored Pre-proline 0 N--CA 1.481 1.117 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -61.69 -23.93 76.97 Favored 'Trans proline' 0 C--N 1.366 1.454 0 C-N-CA 121.7 1.6 . . . . 0.0 112.917 179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -107.42 3.79 25.58 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.638 -0.256 . . . . 0.0 111.16 -173.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.596 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 60.1 tp -54.7 121.67 35.22 Favored Pre-proline 0 C--O 1.245 0.867 0 C-N-CA 124.147 0.979 . . . . 0.0 111.415 -178.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.416 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 15.4 Cg_exo -69.8 132.11 22.59 Favored 'Trans proline' 0 N--CA 1.441 -1.588 0 C-N-CA 121.977 1.785 . . . . 0.0 111.02 176.113 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 19.6 m -65.61 135.58 55.23 Favored 'General case' 0 N--CA 1.425 -1.721 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 177.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 108.83 -17.61 32.55 Favored Glycine 0 N--CA 1.428 -1.875 0 N-CA-C 110.68 -0.968 . . . . 0.0 110.68 -174.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.544 ' OE1' ' HB3' ' A' ' 69' ' ' GLN . 29.0 mt-10 -122.39 179.66 4.5 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-O 121.313 0.578 . . . . 0.0 111.091 176.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.1 m -153.72 168.26 26.87 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 55' ' ' PRO . 28.4 mt -94.54 118.08 66.95 Favored Pre-proline 0 C--N 1.301 -1.539 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.465 ' CB ' ' HG3' ' A' ' 60' ' ' GLU . 3.0 Cg_exo -74.18 141.13 28.82 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.003 2.469 . . . . 0.0 111.555 178.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -76.48 -54.28 6.93 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -174.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.447 ' O ' HG13 ' A' ' 61' ' ' ILE . 66.6 p -94.19 151.87 19.14 Favored 'General case' 0 C--N 1.31 -1.122 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.836 -175.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -53.67 -38.59 64.33 Favored 'General case' 0 C--O 1.238 0.447 0 C-N-CA 123.338 0.655 . . . . 0.0 111.166 178.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -60.14 -53.27 59.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.585 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.465 ' HG3' ' CB ' ' A' ' 55' ' ' PRO . 11.4 pt-20 -66.17 -30.65 71.16 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.777 -178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 57' ' ' THR . 77.3 mt -59.93 -45.23 95.43 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.49 0 CA-C-N 116.339 -0.392 . . . . 0.0 109.944 175.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 27.1 mm-40 -62.0 -37.57 85.35 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 121.216 0.531 . . . . 0.0 110.694 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 -73.6 -52.29 13.95 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.32 -177.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 64.4 m -71.65 -45.73 61.12 Favored 'General case' 0 C--O 1.253 1.25 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.753 -176.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.4 mt -106.37 94.9 5.4 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-O 121.385 0.612 . . . . 0.0 110.002 -174.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 35.4 m -111.33 -52.44 2.79 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.723 178.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.544 ' HB3' ' HD3' ' A' ' 68' ' ' PRO 0.287 45.4 t -140.69 -74.21 0.02 OUTLIER Pre-proline 0 CA--C 1.563 1.451 0 N-CA-C 114.223 1.194 . . . . 0.0 114.223 177.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.544 ' HD3' ' HB3' ' A' ' 67' ' ' SER . 37.1 Cg_exo -61.84 -49.76 6.33 Favored 'Trans proline' 0 C--N 1.384 2.428 0 CA-C-N 121.962 1.737 . . . . 0.0 112.152 -175.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.544 ' HB3' ' OE1' ' A' ' 52' ' ' GLU . 13.6 mm100 -69.25 -35.27 75.93 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.915 -179.284 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -62.55 -37.44 86.15 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.872 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 99.3 mt-30 -67.2 -27.81 67.57 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.634 0.254 . . . . 0.0 111.404 177.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -77.17 -44.96 28.33 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.48 -39.27 93.48 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.964 177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.418 HD23 HD13 ' A' ' 22' ' ' LEU . 22.9 tp -74.43 -21.58 59.54 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 177.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.82 -47.42 55.41 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 111.024 -0.83 . . . . 0.0 111.024 176.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.596 ' SD ' ' HA ' ' A' ' 48' ' ' LEU . 21.9 ptt? -68.06 -32.91 73.58 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -58.35 -50.24 74.33 Favored 'General case' 0 C--N 1.333 -0.122 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.469 ' HB3' HG11 ' A' ' 108' ' ' VAL . 64.8 m -62.4 -33.59 75.06 Favored 'General case' 0 C--O 1.207 -1.132 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.546 178.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.6 -45.22 72.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.116 0.484 . . . . 0.0 110.594 179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.95 -35.94 81.97 Favored 'General case' 0 C--O 1.252 1.184 0 CA-C-O 121.319 0.58 . . . . 0.0 110.141 177.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.428 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 6.2 tt -66.43 -48.0 71.4 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.232 -0.895 . . . . 0.0 108.956 177.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HA ' ' CA ' ' A' ' 106' ' ' GLY . . . -66.2 -11.47 49.95 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -178.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 30.8 m -97.85 -7.51 30.24 Favored 'General case' 0 N--CA 1.42 -1.939 0 CA-C-O 120.853 0.358 . . . . 0.0 110.591 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.19 7.3 87.76 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.33 -178.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -80.71 -30.86 36.28 Favored 'General case' 0 CA--C 1.504 -0.821 0 CA-C-O 121.68 0.752 . . . . 0.0 110.368 -177.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.4 tp -94.12 2.97 55.91 Favored 'General case' 0 C--N 1.303 -1.444 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.698 -177.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.401 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -61.01 -59.27 10.39 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-N 115.141 -0.936 . . . . 0.0 114.054 -178.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -53.04 -26.76 33.49 Favored 'Trans proline' 0 C--N 1.373 1.868 0 C-N-CA 123.681 2.921 . . . . 0.0 113.367 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 3.9 mm? -65.97 -35.31 80.24 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.62 -179.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 21.9 mmt -71.2 -23.62 62.06 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-O 121.243 0.544 . . . . 0.0 111.311 -175.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 41.8 t -67.89 -33.2 74.26 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.114 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 13.9 pt20 -88.8 -15.52 34.4 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.934 -176.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -84.65 -1.27 55.84 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.792 -179.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 76.7 35.19 41.29 Favored Glycine 0 N--CA 1.442 -0.951 0 N-CA-C 111.354 -0.698 . . . . 0.0 111.354 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 6.7 mp -88.29 151.95 49.44 Favored Pre-proline 0 C--N 1.309 -1.174 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -50.77 156.62 4.37 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.343 3.362 . . . . 0.0 113.658 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.19 -39.46 86.61 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.15 177.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -65.25 -37.46 87.3 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 121.083 0.468 . . . . 0.0 110.337 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -49.08 59.84 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.505 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.66 -35.02 68.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.042 -179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.45 -48.67 78.64 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -64.1 -33.82 76.64 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.332 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.401 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -69.54 -30.7 68.58 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.176 0.512 . . . . 0.0 111.067 178.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -78.52 -42.27 29.93 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.955 176.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -67.39 -24.88 65.73 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.846 178.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.53 ' CA ' ' HA ' ' A' ' 82' ' ' ALA . . . 83.87 32.92 22.73 Favored Glycine 0 N--CA 1.422 -2.266 0 N-CA-C 111.13 -0.788 . . . . 0.0 111.13 -179.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -107.65 104.99 14.64 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -176.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.469 HG11 ' HB3' ' A' ' 78' ' ' SER . 33.5 m -76.81 -30.13 18.29 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.533 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.724 -175.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.25 -39.84 65.11 Favored 'General case' 0 C--O 1.248 1.011 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.519 -178.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.61 -43.32 72.96 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.62 176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -56.43 -48.16 77.58 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 123.681 0.613 . . . . 0.0 111.27 -179.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.48 ' HB1' HG11 ' A' ' 25' ' ' VAL . . . -57.91 -48.15 80.73 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.344 -179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 41.2 ttmt -71.97 -40.83 68.35 Favored 'General case' 0 C--O 1.214 -0.78 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.386 -178.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -58.92 -35.01 72.37 Favored 'General case' 0 C--O 1.244 0.772 0 C-N-CA 123.311 0.644 . . . . 0.0 111.603 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . . . . . . . . . 57.8 ttm -67.73 -55.45 13.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.047 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.488 ' O ' ' HB2' ' A' ' 120' ' ' LYS 0.309 0.1 OUTLIER -71.93 -19.26 61.94 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 115.443 1.645 . . . . 0.0 115.443 -176.395 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 33.8 p30 -86.46 -32.65 20.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 119.884 -0.726 . . . . 0.0 112.33 178.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -85.89 -48.05 9.09 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 120.99 0.424 . . . . 0.0 110.843 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -85.85 66.29 9.54 Favored 'General case' 0 N--CA 1.442 -0.839 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 116' ' ' GLN . 65.8 tttm -139.64 89.21 11.88 Favored Pre-proline 0 N--CA 1.424 -1.756 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.844 -174.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -71.91 -23.09 22.46 Favored 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.116 1.878 . . . . 0.0 109.87 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 120' ' ' LYS . 45.3 mt-10 -66.93 127.97 34.55 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.541 176.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -79.67 178.44 8.16 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-O 121.104 0.478 . . . . 0.0 110.73 -176.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.62 154.0 22.07 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -135.86 -54.35 0.77 Allowed 'General case' 0 C--N 1.294 -1.813 0 N-CA-C 114.256 1.206 . . . . 0.0 114.256 -171.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -147.03 46.8 0.71 Allowed Glycine 0 CA--C 1.473 -2.576 0 N-CA-C 108.846 -1.702 . . . . 0.0 108.846 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -130.39 125.49 34.68 Favored 'General case' 0 C--N 1.288 -2.072 0 CA-C-N 114.289 -0.956 . . . . 0.0 110.699 -173.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 42.2 m -73.8 -55.6 6.02 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 175.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 79.8 tttt 57.03 27.51 13.41 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 122.238 1.018 . . . . 0.0 110.783 173.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -169.48 -164.09 0.43 Allowed 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 103.957 -2.609 . . . . 0.0 103.957 -175.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -102.55 169.13 8.85 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 175.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -86.11 123.22 31.16 Favored 'General case' 0 C--O 1.249 1.037 0 C-N-CA 119.325 -0.95 . . . . 0.0 112.251 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -136.46 70.57 1.41 Allowed 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.862 -1.532 . . . . 0.0 106.862 172.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -153.17 175.44 13.04 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.313 -171.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 80.04 106.63 0.07 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 172.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 71.47 -46.76 0.65 Allowed 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 166.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 67.77 31.91 5.62 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.142 0.977 . . . . 0.0 110.819 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 15.4 tpt 70.42 -41.62 0.5 Allowed 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.137 1.375 . . . . 0.0 114.381 175.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.2 m 72.9 -48.45 0.69 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.059 1.344 . . . . 0.0 112.249 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.27 25.47 1.38 Allowed 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.999 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 176.773 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -142.51 92.54 2.43 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -155.48 135.03 12.53 Favored 'General case' 0 C--N 1.297 -1.676 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.131 -179.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.4 mp -97.66 84.16 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.299 -1.624 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 32.8 tp -71.52 -23.5 61.79 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.583 -1.189 . . . . 0.0 110.461 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.27 68.51 0.67 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 124.051 0.941 . . . . 0.0 109.933 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.1 m -90.16 149.81 22.28 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 -179.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.5 mpp? 68.92 93.18 0.08 Allowed 'General case' 0 CA--C 1.51 -0.562 0 O-C-N 123.935 0.772 . . . . 0.0 108.922 -172.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -113.41 116.45 29.65 Favored 'General case' 0 C--N 1.292 -1.895 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.5 p -64.29 128.21 92.96 Favored Pre-proline 0 C--N 1.315 -0.919 0 O-C-N 123.433 0.458 . . . . 0.0 110.285 178.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -76.78 -28.89 5.96 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 121.984 1.789 . . . . 0.0 111.199 177.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.1 -163.42 0.26 Allowed 'General case' 0 C--O 1.237 0.422 0 C-N-CA 124.134 0.974 . . . . 0.0 109.951 -178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -124.08 75.9 0.38 Allowed Glycine 0 C--N 1.296 -1.694 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 177.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -88.75 79.72 1.01 Allowed 'Trans proline' 0 N--CA 1.432 -2.123 0 C-N-CA 122.361 2.041 . . . . 0.0 111.525 -178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -89.61 82.4 6.35 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.46 -56.36 3.5 Favored Glycine 0 N--CA 1.433 -1.533 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -176.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 116.64 -44.28 1.49 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 178.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -168.85 -77.18 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -170.44 -67.52 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 104.259 -2.497 . . . . 0.0 104.259 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.7 t -104.31 75.7 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 170.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.537 ' O ' HG12 ' A' ' 25' ' ' VAL . 11.2 t70 -85.11 128.33 34.61 Favored 'General case' 0 CA--C 1.489 -1.374 0 CA-C-N 114.155 -1.384 . . . . 0.0 110.289 -177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -54.08 -39.7 66.56 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 -176.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -81.04 -25.06 37.41 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.217 0.532 . . . . 0.0 112.099 -172.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 4.2 p -87.12 -28.6 22.4 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.234 178.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 21' ' ' ASP . 12.0 p -87.99 -32.12 5.99 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-O 121.217 0.532 . . . . 0.0 110.419 177.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.438 ' HG ' HG13 ' A' ' 25' ' ' VAL . 87.5 mt -117.19 99.82 7.29 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 177.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 16.1 p -83.71 157.86 63.37 Favored Pre-proline 0 C--N 1.303 -1.433 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.783 -175.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -56.07 -37.05 96.91 Favored 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.034 2.489 . . . . 0.0 112.283 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.03 -27.71 63.8 Favored 'General case' 0 CA--C 1.552 1.051 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 65.2 mt -84.59 -38.31 13.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.695 0.759 . . . . 0.0 109.284 177.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.487 ' HB3' HD13 ' A' ' 35' ' ' LEU . 23.6 mmt -83.57 -17.01 43.2 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB1' ' HB1' ' A' ' 58' ' ' ALA . . . -51.67 -55.76 27.02 Favored Pre-proline 0 CA--C 1.553 1.094 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -71.9 -18.96 27.59 Favored 'Trans proline' 0 C--N 1.371 1.74 0 CA-C-N 120.733 1.297 . . . . 0.0 112.303 -178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 67.5 mt -79.71 -56.15 7.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.458 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' A' ' 31' ' ' MET . 9.9 mp -70.44 -18.62 63.0 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -73.14 -9.97 59.28 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.587 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.511 ' O ' HG22 ' A' ' 40' ' ' VAL . 35.9 t30 -88.58 115.69 26.29 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.23 -24.91 63.56 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 123.347 0.659 . . . . 0.0 112.364 -176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 42' ' ' GLU . 26.4 t0 -66.76 -36.16 81.8 Favored 'General case' 0 C--O 1.269 2.1 0 CA-C-O 122.035 0.921 . . . . 0.0 110.226 -178.56 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 37' ' ' ASN . 8.7 m -78.41 -33.49 17.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 177.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.426 ' HB3' HD13 ' A' ' 54' ' ' LEU . 79.7 mt-30 -60.79 -36.53 79.24 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.986 177.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HB3' ' O ' ' A' ' 39' ' ' ASP . 11.6 tp10 -53.97 -46.01 71.52 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.887 -1.052 . . . . 0.0 109.396 175.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 7.7 mpt_? -75.39 -24.68 57.22 Favored 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 178.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.4 mp -84.26 -19.53 33.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 41' ' ' GLN . 54.9 mt -45.26 -48.74 33.39 Favored Pre-proline 0 CA--C 1.564 1.483 0 N-CA-C 115.118 1.525 . . . . 0.0 115.118 178.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -67.95 -12.96 36.96 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 121.894 1.729 . . . . 0.0 113.13 179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -113.71 -2.68 13.67 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.106 -0.371 . . . . 0.0 111.898 -176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.46 ' HA ' ' SD ' ' A' ' 76' ' ' MET . 6.9 tt -47.53 128.8 10.54 Favored Pre-proline 0 CA--C 1.548 0.881 0 C-N-CA 125.388 1.475 . . . . 0.0 110.718 -178.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.58 ' HD3' ' SD ' ' A' ' 76' ' ' MET . 30.6 Cg_exo -61.47 130.24 31.09 Favored 'Trans proline' 0 C--N 1.359 1.089 0 C-N-CA 123.165 2.577 . . . . 0.0 112.142 -178.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.2 m -49.23 116.38 1.68 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 124.317 1.047 . . . . 0.0 112.877 -176.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 94.65 -16.81 60.39 Favored Glycine 0 N--CA 1.437 -1.277 0 CA-C-N 115.615 -0.72 . . . . 0.0 114.333 174.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -96.3 -179.16 4.55 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 117.903 0.852 . . . . 0.0 111.381 -176.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.8 m -126.17 169.78 12.48 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-O 120.987 0.422 . . . . 0.0 110.821 -176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 41' ' ' GLN . 72.6 mt -94.92 111.17 53.55 Favored Pre-proline 0 N--CA 1.433 -1.311 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -61.88 127.6 21.91 Favored 'Trans proline' 0 N--CA 1.453 -0.887 0 C-N-CA 121.342 1.361 . . . . 0.0 109.42 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -80.75 -53.06 6.84 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -173.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 57.1 p -92.83 158.41 15.88 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -177.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.499 ' O ' ' HG2' ' A' ' 62' ' ' GLN . . . -58.72 -33.89 70.72 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 174.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -54.26 -51.04 65.8 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.07 176.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.559 ' HA ' ' ND2' ' A' ' 63' ' ' ASN . 19.3 mm-40 -66.64 -42.86 86.02 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.805 178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 88.9 mt -55.63 -51.11 62.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-O 120.675 0.274 . . . . 0.0 110.514 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 11.5 mm100 -67.75 -23.43 65.24 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.598 -178.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.559 ' ND2' ' HA ' ' A' ' 60' ' ' GLU . 7.6 p30 -91.89 -35.81 13.83 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -175.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.1 m -89.57 -28.02 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.002 -177.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 39.6 mt -115.47 82.5 1.76 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.2 p -127.88 -36.41 2.0 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.544 0.687 . . . . 0.0 110.724 173.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.517 ' HB3' ' HD2' ' A' ' 68' ' ' PRO . 14.4 m -83.29 -175.91 0.71 Allowed Pre-proline 0 CA--C 1.567 1.613 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 176.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.517 ' HD2' ' HB3' ' A' ' 67' ' ' SER . 1.4 Cg_exo -40.44 -22.76 0.11 Allowed 'Trans proline' 0 C--N 1.386 2.525 0 C-N-CA 124.398 3.398 . . . . 0.0 115.65 175.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -57.95 -28.99 64.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.408 0.283 . . . . 0.0 111.655 175.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -67.79 -37.39 81.97 Favored 'General case' 0 C--O 1.213 -0.862 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.872 176.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -67.89 -30.98 70.46 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -69.21 -47.67 64.19 Favored 'General case' 0 C--O 1.247 0.973 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.955 178.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 76' ' ' MET . . . -70.52 -35.52 73.21 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.23 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.9 tp -74.21 -20.47 60.18 Favored 'General case' 0 C--N 1.306 -1.325 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 177.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.38 -42.29 93.99 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.795 176.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . 0.58 ' SD ' ' HD3' ' A' ' 49' ' ' PRO . 24.1 ptt? -69.56 -32.57 71.44 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-O 121.223 0.535 . . . . 0.0 109.684 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -63.47 -49.29 74.2 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.607 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -59.54 -41.77 90.83 Favored 'General case' 0 N--CA 1.441 -0.921 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.176 179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.39 77.88 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.422 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.3 -32.22 73.76 Favored 'General case' 0 C--O 1.249 1.053 0 CA-C-O 121.214 0.531 . . . . 0.0 110.857 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.474 ' O ' ' HA2' ' A' ' 106' ' ' GLY . 5.4 tt -67.05 -49.94 63.5 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 177.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.53 -30.4 70.62 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 122.98 0.512 . . . . 0.0 111.275 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.492 ' HB3' ' NE2' ' A' ' 85' ' ' GLN . 48.8 m -64.75 -36.6 84.82 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.52 176.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 105.61 -17.04 43.44 Favored Glycine 0 N--CA 1.443 -0.869 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.492 ' NE2' ' HB3' ' A' ' 83' ' ' SER . 1.3 mp0 -69.99 -21.45 63.23 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 20.1 tp -93.62 1.33 56.68 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 121.308 0.575 . . . . 0.0 110.065 -178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.448 ' HA2' ' HB1' ' A' ' 103' ' ' ALA . . . -62.89 -60.95 6.94 Favored Glycine 0 CA--C 1.527 0.82 0 CA-C-N 115.648 -0.705 . . . . 0.0 113.323 179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -55.62 -24.02 43.19 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 123.848 3.032 . . . . 0.0 113.061 179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.561 ' O ' ' HG2' ' A' ' 92' ' ' GLN . 4.0 mm? -67.26 -27.85 67.55 Favored 'General case' 0 C--O 1.208 -1.13 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.198 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.5 mmt -78.22 -21.8 49.44 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.536 0.684 . . . . 0.0 110.94 -178.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 22.7 t -75.21 -22.69 57.76 Favored 'General case' 0 N--CA 1.429 -1.491 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.304 -178.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 89' ' ' LEU . 10.8 pt20 -80.69 -19.55 44.89 Favored 'General case' 0 N--CA 1.472 0.663 0 O-C-N 121.714 -0.617 . . . . 0.0 111.604 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.537 ' HB2' HD13 ' A' ' 95' ' ' LEU . 60.7 m-85 -88.42 -13.96 39.19 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.921 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 77.96 38.26 27.21 Favored Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.374 -1.091 . . . . 0.0 110.374 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.537 HD13 ' HB2' ' A' ' 93' ' ' PHE . 1.5 mp -73.15 161.47 79.14 Favored Pre-proline 0 C--N 1.316 -0.883 0 CA-C-N 115.281 -0.459 . . . . 0.0 111.025 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.31 141.93 23.34 Favored 'Trans proline' 0 C--N 1.368 1.559 0 C-N-CA 123.3 2.667 . . . . 0.0 112.175 179.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HA ' HG12 ' A' ' 100' ' ' VAL . . . -60.15 -35.91 76.37 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.349 0.595 . . . . 0.0 110.723 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -68.48 -36.93 79.65 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.108 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.13 -44.91 44.36 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.483 -178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . 0.459 HG12 ' HA ' ' A' ' 97' ' ' ALA . 14.9 p -64.84 -33.55 64.29 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.582 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.439 ' O ' ' HG2' ' A' ' 105' ' ' LYS . 8.9 tp10 -61.12 -52.71 63.73 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.44 -37.05 77.12 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.456 -179.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.448 ' HB1' ' HA2' ' A' ' 87' ' ' GLY . . . -64.78 -36.7 85.15 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.928 177.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -73.96 -30.97 62.8 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.934 176.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 101' ' ' GLU . 10.3 mmpt? -79.11 -21.18 47.02 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.288 0.565 . . . . 0.0 110.298 179.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.474 ' HA2' ' O ' ' A' ' 81' ' ' LEU . . . 80.13 31.82 37.51 Favored Glycine 0 N--CA 1.423 -2.221 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 -178.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -105.49 103.27 12.76 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 28.3 m -71.92 -30.87 38.69 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -173.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -74.89 -43.02 56.64 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.915 -0.129 . . . . 0.0 111.173 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.54 -40.37 95.48 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 177.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 115' ' ' MET . 82.5 t80 -59.81 -51.6 69.06 Favored 'General case' 0 CA--C 1.503 -0.838 0 O-C-N 123.56 0.537 . . . . 0.0 109.957 177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ALA . . . . . . . . . . . . . . . -56.84 -46.75 81.53 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.865 0.728 . . . . 0.0 111.962 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 46.9 tttp -67.13 -51.35 55.04 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.619 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.12 68.92 Favored 'General case' 0 C--O 1.249 1.066 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.609 -175.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' MET . . . . . 0.608 ' HB2' ' O ' ' A' ' 111' ' ' PHE . 0.0 OUTLIER -62.41 -56.12 21.26 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 115.311 -0.859 . . . . 0.0 108.964 179.051 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.12 -28.03 64.0 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -67.31 -47.86 69.32 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 120.958 0.409 . . . . 0.0 111.647 177.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -82.51 -35.25 27.53 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.166 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . 56.36 36.13 27.01 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.377 1.071 . . . . 0.0 111.1 179.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.602 ' HD2' ' O ' ' A' ' 120' ' ' LYS 0.356 0.1 OUTLIER 53.4 93.79 0.05 OUTLIER Pre-proline 0 N--CA 1.472 0.638 0 C-N-CA 125.054 1.342 . . . . 0.0 112.819 -175.082 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.412 ' HB3' ' HD2' ' A' ' 124' ' ' LYS . 37.4 Cg_exo -61.29 -31.11 88.98 Favored 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.756 2.304 . . . . 0.0 112.946 -176.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 57.95 -81.54 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.393 1.077 . . . . 0.0 110.714 -172.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -119.85 100.01 6.97 Favored 'General case' 0 N--CA 1.422 -1.832 0 CA-C-O 121.672 0.749 . . . . 0.0 109.324 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.412 ' HD2' ' HB3' ' A' ' 121' ' ' PRO . 50.8 mttp -139.98 43.88 1.93 Allowed 'General case' 0 C--N 1.292 -1.935 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 169.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -83.77 14.74 3.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 112.037 -2.347 . . . . 0.0 110.092 -172.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 133.77 -31.03 2.89 Favored Glycine 0 C--N 1.3 -1.469 0 N-CA-C 108.921 -1.672 . . . . 0.0 108.921 -175.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ASP . . . . . . . . . . . . . 24.8 t70 70.66 112.29 0.05 Allowed 'General case' 0 CA--C 1.509 -0.618 0 C-N-CA 125.564 1.545 . . . . 0.0 112.631 176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . . . . . . . . . 39.4 m -80.19 88.83 5.45 Favored 'General case' 0 N--CA 1.416 -2.157 0 CA-C-O 121.695 0.76 . . . . 0.0 110.068 178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -96.82 -9.41 28.79 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -82.67 105.82 14.01 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.291 -1.322 . . . . 0.0 108.45 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -160.93 23.32 0.14 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 -178.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 15.7 mmtp -169.61 -55.45 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.473 0 C-N-CA 124.854 1.262 . . . . 0.0 109.816 -175.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 63.73 67.69 0.62 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 113.774 -1.557 . . . . 0.0 109.513 -170.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -131.81 65.14 1.58 Allowed 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 114.072 -1.422 . . . . 0.0 107.851 175.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -89.07 99.34 12.35 Favored 'General case' 0 N--CA 1.426 -1.626 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.209 -177.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 73.57 120.88 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.821 1.325 . . . . 0.0 111.926 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.3 -35.05 61.33 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.774 178.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' MET . . . . . . . . . . . . . 21.2 ttt 57.35 65.53 1.34 Allowed 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.606 -1.179 . . . . 0.0 109.282 -178.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.4 m -68.55 -37.28 79.81 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.125 -1.398 . . . . 0.0 112.019 -173.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 87.0 mt -107.12 -68.05 0.91 Allowed 'General case' 0 C--N 1.311 -1.09 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 -179.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 . . . . . 0 C--N 1.312 -1.037 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 177.954 . . . . . . . . 0 0 . 1 stop_ save_